data_1hbw_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 1hbw _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.931 0.396 . . . . 0.0 111.313 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.75 -31.29 6.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.817 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.502 ' O ' ' C ' ' A' ' 55' ' ' THR . 9.0 mt 64.47 -80.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.239 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.502 ' C ' ' O ' ' A' ' 54' ' ' LEU . 97.2 m 6.54 -90.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.46 -70.05 0.12 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.438 ' HA ' ' HB2' ' A' ' 60' ' ' ARG . 4.6 t -50.18 -25.08 2.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.577 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.722 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.39 73.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.62 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.585 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 20.0 m -69.49 -15.72 63.31 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.438 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -73.38 -74.03 0.19 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.475 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.712 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.4 mm? -62.06 -28.29 69.49 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 119.362 -0.935 . . . . 0.0 109.992 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.462 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 2.6 tt0 -65.08 -39.04 92.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.2 ttm105 -66.73 -28.18 68.21 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.414 ' CD1' ' CD2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -72.77 -27.42 61.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.748 178.533 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.442 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 0.1 OUTLIER -78.01 -32.96 51.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.015 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.75 -22.93 45.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.6 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -77.56 -29.52 52.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.884 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.466 ' O ' ' CB ' ' A' ' 69' ' ' LEU . 0.1 OUTLIER 72.34 -165.57 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.778 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.466 ' CB ' ' O ' ' A' ' 68' ' ' PHE . 8.0 tp 86.88 -33.05 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.85 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.414 ' CD2' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -113.68 -16.39 12.33 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.474 0.178 . . . . 0.0 111.225 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.421 HD11 ' CE1' ' A' ' 68' ' ' PHE . 60.8 mt -51.64 -37.18 19.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.714 0.293 . . . . 0.0 111.271 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.43 ' CG ' ' HD2' ' A' ' 73' ' ' PRO . 1.4 t80 -109.03 142.24 25.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.815 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.43 ' HD2' ' CG ' ' A' ' 72' ' ' PHE . 51.2 Cg_endo -69.15 -28.8 27.74 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.458 2.106 . . . . 0.0 112.291 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -112.13 -179.48 3.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.739 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -98.06 -49.29 4.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.056 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.07 146.47 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.023 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -103.13 -80.05 0.52 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.738 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 71.85 -57.58 0.61 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.298 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.39 6.16 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.684 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 58.0 mt -61.16 -29.97 46.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 111.144 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.4 mt -73.2 -26.7 61.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.049 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.8 -19.63 22.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.5 mtm -93.01 -22.88 18.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.039 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -86.8 -60.72 1.91 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.65 120.41 0.91 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.882 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -169.76 -41.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.018 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -74.08 -38.74 63.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.029 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.496 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 5.1 m-20 -70.36 -11.41 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.465 ' N ' ' CD1' ' A' ' 89' ' ' ILE . 2.1 mp -91.55 -54.95 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.24 -19.63 64.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.33 4.26 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.158 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 3.3 mm? -53.08 -26.18 15.33 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.081 0.467 . . . . 0.0 109.841 178.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.441 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 0.5 OUTLIER -92.55 -38.05 12.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.165 179.206 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.5 m -63.3 -15.05 56.08 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.012 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.7 -28.85 1.11 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.41 -0.9 . . . . 0.0 113.395 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.412 ' CB ' ' O ' ' A' ' 92' ' ' LEU . 0.5 OUTLIER -104.31 5.41 34.54 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 21.9 p90 -36.69 139.56 0.18 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.688 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 28.0 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.082 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.828 0.347 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.64 -31.29 6.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.858 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.499 ' O ' ' C ' ' B' ' 55' ' ' THR . 9.0 mt 64.32 -80.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.215 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.499 ' C ' ' O ' ' B' ' 54' ' ' LEU . 97.6 m 6.39 -90.47 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -70.17 0.11 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.948 0.404 . . . . 0.0 112.083 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.444 ' HA ' ' HB2' ' B' ' 60' ' ' ARG . 4.6 t -50.15 -25.0 2.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.562 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.712 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.43 73.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.612 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.581 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 19.9 m -69.45 -15.68 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.444 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.3 OUTLIER -73.46 -74.0 0.19 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.505 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.4 mm? -62.02 -28.34 69.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.841 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.462 ' CB ' ' O ' ' B' ' 58' ' ' GLU . 2.6 tt0 -65.15 -38.97 92.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.1 ttm105 -66.82 -28.03 68.03 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.417 ' CD1' ' CD2' ' B' ' 70' ' ' LEU . 0.1 OUTLIER -72.96 -27.49 61.85 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.567 178.644 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.442 ' HB2' ' HB2' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -77.96 -33.02 51.73 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.027 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.67 -23.01 45.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.596 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -77.47 -29.48 52.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.987 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . 0.452 ' O ' ' CB ' ' B' ' 69' ' ' LEU . 0.1 OUTLIER 72.24 -165.46 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.826 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' B' ' 68' ' ' PHE . 0.3 OUTLIER 86.58 -33.01 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.891 179.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.417 ' CD2' ' CD1' ' B' ' 64' ' ' LEU . 0.1 OUTLIER -113.49 -16.37 12.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.525 0.203 . . . . 0.0 111.254 -179.779 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . 0.417 HD11 ' CE1' ' B' ' 68' ' ' PHE . 60.9 mt -51.66 -37.1 19.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.767 0.318 . . . . 0.0 111.354 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . 0.432 ' CG ' ' HD2' ' B' ' 73' ' ' PRO . 1.4 t80 -109.04 142.1 24.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.774 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' B' ' 72' ' ' PHE . 51.3 Cg_endo -69.14 -28.75 27.84 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.447 2.098 . . . . 0.0 112.361 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -111.84 179.77 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.875 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -93.45 -60.33 1.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.988 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.49 155.72 26.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.856 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.429 HD22 ' CZ ' ' B' ' 72' ' ' PHE . 1.9 mt -109.21 -79.04 0.59 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.785 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 72.85 -57.87 0.62 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.399 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.44 6.12 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.768 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.421 HD12 HG22 ' B' ' 80' ' ' ILE . 58.1 mt -61.1 -30.08 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.057 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 1.4 mt -73.11 -26.82 61.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.065 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.68 -19.65 22.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.212 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 9.6 mtm -93.05 -22.84 18.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 0.0 111.053 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -86.79 -60.76 1.9 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.901 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.68 120.53 0.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.98 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -169.78 -42.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -73.71 -38.72 64.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.982 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . 0.48 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 5.1 m-20 -70.38 -11.47 60.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.34 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.465 ' CD1' ' N ' ' B' ' 89' ' ' ILE . 2.1 mp -91.52 -55.09 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.21 -19.55 64.62 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.136 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.28 4.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.255 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 3.3 mm? -53.12 -26.1 15.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.047 0.451 . . . . 0.0 109.833 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.443 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -92.56 -38.12 12.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.087 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -63.21 -15.23 56.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.98 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.55 -28.96 1.12 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.412 -0.899 . . . . 0.0 113.37 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.413 ' CB ' ' O ' ' B' ' 92' ' ' LEU . 0.5 OUTLIER -104.23 5.33 34.7 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.327 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.443 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 21.5 p90 -36.73 139.51 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.68 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 27.2 t . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.103 179.965 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.417 ' HB3' ' CE1' ' B' ' 53' ' ' HIS . . . . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.683 0.278 . . . . 0.0 111.049 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.434 ' CE1' ' HB3' ' B' ' 52' ' ' ALA . 90.0 m-70 65.23 153.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.438 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.514 ' HA ' ' HB3' ' A' ' 58' ' ' GLU . 4.6 mp 64.26 -137.52 0.29 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.705 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.42 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.7 m 27.94 -84.94 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 54' ' ' LEU . 4.1 mm-40 -66.41 -64.43 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.138 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.41 ' HB ' ' CG1' ' B' ' 57' ' ' VAL . 20.6 t -56.84 -44.11 81.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.193 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.68 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 4.7 pt-20 -55.4 -48.68 73.99 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-O 121.451 0.643 . . . . 0.0 109.514 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.436 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 1.2 m -64.38 -19.06 65.25 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.654 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.04 -73.85 0.19 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.228 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.5 mm? -62.97 -25.36 68.33 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.09 -179.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.45 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 2.5 tt0 -69.33 -38.3 78.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.38 -30.36 71.17 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 177.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.451 178.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -32.15 64.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.163 178.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.96 -23.12 44.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.843 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.99 -22.84 33.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 63.76 175.65 0.17 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.967 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tp -129.71 -66.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.973 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.5 mt -124.6 47.25 2.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.18 -58.05 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.086 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -113.73 101.72 54.08 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.82 -51.2 1.36 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.391 2.06 . . . . 0.0 112.348 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.57 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.804 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -175.99 118.22 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.002 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -159.08 -63.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 74.59 5.66 4.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -130.94 -34.04 1.51 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.659 0.266 . . . . 0.0 111.354 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -28.02 61.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.333 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.67 -65.03 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.005 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.67 -18.75 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.07 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -80.72 -31.83 35.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 mtm -89.1 -18.2 27.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.98 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -94.25 -40.29 10.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.91 0.386 . . . . 0.0 110.847 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.03 139.07 30.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.45 18.16 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.112 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.78 23.25 11.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.128 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.83 -11.29 60.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.896 0.379 . . . . 0.0 110.936 179.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.463 ' N ' ' CD1' ' A' ' 89' ' ' ILE . 2.4 mp -93.31 -50.93 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.83 -21.58 66.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.459 -0.791 . . . . 0.0 108.931 177.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.02 -48.97 7.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.195 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.86 -25.27 56.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.202 0.525 . . . . 0.0 109.778 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.12 -36.68 11.96 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.225 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.0 m -65.82 -15.41 62.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.933 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.37 -36.36 0.65 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.218 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.94 -2.28 40.93 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.4 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 18.2 p90 38.78 75.84 0.07 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.806 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 42.1 t . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.935 -179.974 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . 0.434 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . . . . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.713 0.292 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . 0.417 ' CE1' ' HB3' ' A' ' 52' ' ' ALA . 89.8 m-70 65.38 153.66 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.027 0.442 . . . . 0.0 111.238 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.504 ' HA ' ' HB3' ' B' ' 58' ' ' GLU . 4.5 mp 64.13 -137.5 0.3 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.768 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.42 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.4 m 27.88 -84.83 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' B' ' 54' ' ' LEU . 4.1 mm-40 -66.45 -64.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.794 0.331 . . . . 0.0 111.192 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.41 ' CG1' ' HB ' ' A' ' 57' ' ' VAL . 20.6 t -56.86 -44.12 81.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.119 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.675 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 4.7 pt-20 -55.54 -48.49 74.64 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.336 0.589 . . . . 0.0 109.477 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 1.2 m -64.5 -19.06 65.36 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.24 -73.66 0.2 Allowed 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.203 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.5 mm? -63.14 -25.16 68.22 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.126 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' B' ' 58' ' ' GLU . 2.4 tt0 -69.52 -38.2 77.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 176.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -30.42 71.22 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.395 178.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -32.21 64.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.129 179.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -23.2 44.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.834 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -22.86 33.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.145 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 63.81 175.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.911 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 mp -129.59 -67.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 42.7 mt -124.01 47.36 2.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.104 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.27 -58.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -113.66 101.79 54.12 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.85 -51.19 1.35 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.325 2.017 . . . . 0.0 112.462 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.66 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.114 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -152.1 -174.64 4.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.924 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 68.93 114.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.069 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.0 mp -101.64 47.62 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.645 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -127.25 -34.03 2.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.18 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -28.06 62.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.195 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.61 -65.05 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.988 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -18.8 63.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.04 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -80.7 -31.88 36.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 0.0 110.742 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 1.2 mtm -88.98 -18.34 27.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.93 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -94.28 -40.18 10.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.774 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.12 139.03 30.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.882 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.6 tp -94.51 18.16 11.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.91 23.2 11.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.128 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.92 -11.25 60.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 0.0 110.893 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.459 ' CD1' ' N ' ' B' ' 89' ' ' ILE . 2.4 mp -93.11 -51.06 11.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.02 -21.34 66.83 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.809 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.07 -49.03 7.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.211 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.85 -25.27 56.03 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.104 0.478 . . . . 0.0 109.726 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.05 -36.76 11.97 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.154 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.9 m -65.87 -15.45 62.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.814 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.33 -36.46 0.65 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.27 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.96 -2.33 40.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.997 0.399 . . . . 0.0 112.049 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.403 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 18.0 p90 38.8 75.79 0.07 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.749 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.043 179.952 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.108 0 CA-C-O 120.922 0.392 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 51.63 -97.74 0.06 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.929 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 58' ' ' GLU . 0.4 OUTLIER 66.14 -73.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.601 0.238 . . . . 0.0 111.335 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.448 ' C ' ' O ' ' A' ' 54' ' ' LEU . 55.7 m 9.34 -76.54 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.6 pt-20 -63.27 -60.56 3.24 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.606 ' CG1' ' HB ' ' B' ' 57' ' ' VAL . 17.2 t -59.12 -48.58 86.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.651 -179.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.704 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.02 -46.41 68.4 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 121.292 0.568 . . . . 0.0 109.555 179.035 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.7 -21.42 66.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.544 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.432 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.3 -71.59 0.25 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.381 -179.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -62.1 -30.68 71.18 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.812 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.438 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 45.7 tt0 -63.29 -37.56 87.73 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.89 -29.93 69.15 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.8 -27.78 64.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 121.484 0.659 . . . . 0.0 109.516 178.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -78.56 -31.77 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.502 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.67 -33.43 66.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.764 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.462 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 3.9 mp -63.08 -26.05 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.462 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 3.2 m-85 68.71 -61.0 0.43 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.442 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 70.71 -65.38 0.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.768 0.318 . . . . 0.0 110.667 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 30.9 mt -137.41 53.9 1.85 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.606 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.431 ' HB ' ' CD2' ' A' ' 68' ' ' PHE . 36.1 mm -127.14 -45.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.187 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.431 ' CD2' ' O ' ' A' ' 72' ' ' PHE . 37.6 p90 -48.0 105.5 0.5 Allowed Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.213 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -79.15 132.65 10.49 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.136 . . . . 0.0 112.289 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.0 -46.86 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.61 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -165.67 65.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.043 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.56 -81.16 0.36 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.7 mt -96.93 112.09 24.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.647 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.475 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 4.0 t0 -178.94 89.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.98 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.457 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 13.6 ptt? -53.09 -45.26 68.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.684 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.444 ' HB ' ' CD2' ' B' ' 81' ' ' LEU . 45.1 mm -65.07 -49.57 78.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.775 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.475 ' HB2' ' HB3' ' A' ' 78' ' ' ASP . 1.2 mm? -64.84 -21.29 66.76 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.457 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 9.0 pttp -93.54 -24.71 17.87 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' MET . . . . . 0.434 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 18.5 ptp -93.91 -15.26 25.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.82 -65.37 0.31 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.75 0.309 . . . . 0.0 110.935 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.9 m 65.04 65.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 mp -150.15 32.67 0.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.703 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -112.99 -35.91 5.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.994 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -71.75 -13.47 61.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 111.031 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.444 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 26.2 mm -86.16 -57.37 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.513 ' O ' ' HB ' ' A' ' 94' ' ' THR . 30.2 tt0 -64.13 -18.84 64.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.303 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.41 ' O ' HG21 ' A' ' 94' ' ' THR . . . -83.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.525 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 96' ' ' LEU . 6.5 mp -49.31 -29.22 5.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.024 0.44 . . . . 0.0 110.448 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 4.3 mm? -85.24 -38.97 18.31 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.5 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.513 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 8.7 t -73.16 -7.59 52.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.957 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -113.05 -32.53 2.19 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 2.8 mm? -98.31 -7.42 29.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.975 0.388 . . . . 0.0 111.843 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 44.8 p90 31.92 42.03 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.887 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.4 p . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.284 -179.682 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.854 0.359 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . 0.4 ' O ' ' N ' ' B' ' 55' ' ' THR . 5.5 t-80 51.79 -97.75 0.06 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.896 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.551 ' HB3' ' HG2' ' B' ' 58' ' ' GLU . 0.4 OUTLIER 66.18 -73.94 0.07 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.664 0.268 . . . . 0.0 111.317 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.453 ' C ' ' O ' ' B' ' 54' ' ' LEU . 57.3 m 9.45 -76.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.6 pt-20 -63.31 -60.47 3.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.606 ' HB ' ' CG1' ' A' ' 57' ' ' VAL . 17.1 t -59.05 -48.63 86.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 122.157 -0.339 . . . . 0.0 111.665 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.722 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.08 -46.37 68.58 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.345 0.593 . . . . 0.0 109.583 179.11 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.66 -21.52 66.75 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.536 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.424 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.15 -71.83 0.24 Allowed 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.285 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -62.04 -30.77 71.2 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 119.467 -0.893 . . . . 0.0 109.798 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.44 ' HB2' ' CD1' ' A' ' 61' ' ' LEU . 45.6 tt0 -63.14 -37.53 87.6 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.79 -29.97 69.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.258 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -27.81 64.14 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.498 178.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -78.59 -31.75 47.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.553 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.65 -33.34 66.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.861 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.456 ' O ' ' HB2' ' B' ' 68' ' ' PHE . 3.9 mp -63.11 -26.2 68.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.378 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . 0.492 ' O ' ' HB2' ' B' ' 69' ' ' LEU . 3.2 m-85 68.77 -60.52 0.44 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.631 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.492 ' HB2' ' O ' ' B' ' 68' ' ' PHE . 2.0 mt 69.51 -64.58 0.34 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.818 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 30.7 mt -137.57 53.86 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.973 0.416 . . . . 0.0 110.666 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . 0.427 ' HB ' ' CD2' ' B' ' 68' ' ' PHE . 36.8 mm -127.21 -44.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.173 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . 0.43 ' O ' ' CD2' ' B' ' 72' ' ' PHE . 37.7 p90 -47.96 105.42 0.49 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.212 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -79.11 132.69 10.56 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.532 2.154 . . . . 0.0 112.24 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.2 -50.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.12 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.34 31.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.88 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -141.79 136.9 31.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.856 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 mt 65.47 83.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.047 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . 0.457 ' HB3' ' HB2' ' B' ' 81' ' ' LEU . 4.0 t0 -173.36 88.37 0.07 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.856 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.478 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 13.7 ptt? -53.02 -45.2 67.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.639 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.448 ' HA ' ' HG2' ' B' ' 83' ' ' MET . 45.0 mm -65.22 -49.49 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.686 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.457 ' HB2' ' HB3' ' B' ' 78' ' ' ASP . 1.2 mm? -64.96 -21.22 66.8 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . 0.478 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 8.9 pttp -93.64 -24.66 17.81 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' MET . . . . . 0.448 ' HG2' ' HA ' ' B' ' 80' ' ' ILE . 18.4 ptp -93.87 -15.22 25.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.621 0.248 . . . . 0.0 111.651 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.74 -65.33 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.726 0.298 . . . . 0.0 110.975 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 43.0 m 65.13 64.89 0.6 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 mp -149.43 32.74 0.72 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.738 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -113.15 -36.05 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.199 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -71.72 -13.45 61.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 111.047 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.443 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 26.0 mm -86.15 -57.43 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.511 ' O ' ' HB ' ' B' ' 94' ' ' THR . 30.1 tt0 -63.9 -19.08 64.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.354 178.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . 0.401 ' O ' HG21 ' B' ' 94' ' ' THR . . . -83.84 -67.55 0.78 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.653 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' B' ' 96' ' ' LEU . 6.5 mp -49.31 -29.37 5.93 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.961 0.41 . . . . 0.0 110.37 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 4.3 mm? -85.14 -38.93 18.47 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.56 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 8.8 t -73.15 -7.7 52.55 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.983 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -112.92 -32.49 2.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.857 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 2.8 mm? -98.39 -7.39 28.83 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 117.023 0.411 . . . . 0.0 111.753 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 44.5 p90 31.82 42.11 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.843 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.4 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.396 -179.786 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.784 0.326 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.6 p-80 -106.72 86.94 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.036 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.402 ' O ' ' CG ' ' A' ' 58' ' ' GLU . 11.1 mp -128.41 8.93 6.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.301 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.461 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.2 OUTLIER -52.8 -56.29 16.79 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.612 -179.796 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.66 -42.64 64.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.247 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 2.5 t -62.99 -38.71 82.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 CA-C-O 120.868 0.366 . . . . 0.0 111.114 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.659 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -61.22 -52.05 66.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.851 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 t -61.28 -20.22 62.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.291 177.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.419 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 11.4 tpp180 -69.66 -73.59 0.15 Allowed 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.346 -179.14 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.64 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.2 mm? -62.63 -30.16 71.15 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.024 -1.071 . . . . 0.0 110.025 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.41 ' HB2' HD11 ' B' ' 61' ' ' LEU . 65.4 tt0 -62.5 -36.67 83.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.314 177.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.86 -15.28 48.77 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.431 ' CD1' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -86.27 -21.48 27.34 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.239 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.512 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 2.4 mm-40 -112.47 -18.32 12.46 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.331 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.29 89.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.405 ' N ' ' O ' ' A' ' 65' ' ' GLU . 7.0 mt 62.78 17.1 9.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.38 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.4 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 1.4 t80 -103.51 98.4 8.3 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.728 0.299 . . . . 0.0 111.026 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tt -177.19 -72.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.024 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.27 -39.02 0.15 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.915 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.6 mm -48.72 -26.99 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.566 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.73 77.19 0.39 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.847 0.356 . . . . 0.0 111.0 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.26 -46.66 1.34 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.575 2.183 . . . . 0.0 112.3 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.56 74.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.003 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 67.84 -69.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.058 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -70.66 138.67 50.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 pp -100.55 131.4 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.912 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.89 -38.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.954 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.06 -23.18 31.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.096 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.9 mp -62.6 -50.76 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.335 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.37 -11.13 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.475 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -88.55 -22.92 23.32 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.67 0.271 . . . . 0.0 111.191 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.5 mtm -116.1 -43.54 2.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.353 . . . . 0.0 111.002 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.53 89.69 3.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.869 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 87.6 p -158.35 154.81 27.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.08 13.69 18.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.261 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.84 17.21 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.246 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 0.3 OUTLIER -73.35 -14.61 61.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.07 179.779 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.408 ' CG2' ' HB ' ' B' ' 89' ' ' ILE . 10.6 mm -92.99 -50.37 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -63.4 -21.86 66.54 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.93 -52.0 5.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.1 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 2.3 mm? -52.33 -27.34 14.99 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.182 0.515 . . . . 0.0 109.619 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.426 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 0.2 OUTLIER -91.01 -36.93 13.78 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.04 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.21 -13.62 50.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.872 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.71 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.214 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.22 3.63 41.11 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 21.2 p90 -41.84 133.22 2.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.596 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.462 0.173 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.992 179.649 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.846 0.355 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 18.3 p-80 -106.83 87.04 2.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.942 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 11.0 mp -128.38 8.91 6.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.418 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.465 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -52.77 -56.33 16.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 111.523 -179.787 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.77 -42.59 65.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.227 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.425 ' O ' ' HB3' ' B' ' 60' ' ' ARG . 2.4 t -62.82 -38.76 82.64 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-O 120.926 0.393 . . . . 0.0 111.172 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.64 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -61.26 -52.08 66.24 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 7.7 t -61.29 -20.26 62.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.381 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.425 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 11.5 tpp180 -69.69 -73.58 0.16 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.297 -179.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.2 mm? -62.45 -30.45 71.25 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.081 -1.048 . . . . 0.0 110.018 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -62.45 -36.49 82.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.372 177.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.94 -15.3 48.4 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.634 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.434 ' CD1' HD12 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -86.32 -21.5 27.24 Favored 'General case' 0 CA--C 1.523 -0.093 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.289 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.512 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 2.4 mm-40 -112.38 -18.43 12.47 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.384 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.23 89.19 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.952 0.406 . . . . 0.0 111.007 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.403 ' N ' ' O ' ' B' ' 65' ' ' GLU . 7.0 mt 62.92 16.87 9.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.359 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -103.32 98.34 8.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.758 0.314 . . . . 0.0 110.994 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tp -176.93 -73.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.998 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 -39.02 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.981 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 16.5 mm -48.57 -27.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.637 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.78 77.22 0.39 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.972 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.1 -46.59 1.43 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.525 2.15 . . . . 0.0 112.429 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.57 74.0 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 67.8 -67.83 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.145 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.28 138.17 49.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.979 0.418 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.17 129.98 46.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.828 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.55 -38.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.936 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.07 -23.2 32.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.172 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.9 mp -62.36 -50.95 77.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.376 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.4 -11.0 47.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.55 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -88.66 -22.77 23.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.739 0.304 . . . . 0.0 111.265 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.6 mtm -116.26 -43.52 2.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.91 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.57 89.74 3.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 86.5 p -158.4 154.8 27.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.833 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 mt -92.06 13.67 18.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.93 17.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.272 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 0.3 OUTLIER -73.36 -14.54 61.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.102 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.408 ' HB ' ' CG2' ' A' ' 89' ' ' ILE . 10.6 mm -93.05 -50.34 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -63.39 -21.82 66.52 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.04 -51.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.994 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 2.3 mm? -52.35 -27.32 15.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.282 0.563 . . . . 0.0 109.597 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 0.2 OUTLIER -91.08 -36.84 13.78 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.078 178.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.18 -13.71 50.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.916 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.7 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.195 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.19 3.72 41.28 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 21.4 p90 -41.82 133.16 2.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.698 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 3.0 p . . . . . 0 CA--C 1.532 0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.048 179.662 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.564 0.221 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 63.6 -80.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.977 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.418 ' O ' ' C ' ' A' ' 55' ' ' THR . 0.8 OUTLIER -94.78 -68.12 0.82 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.827 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.9 m 22.23 -86.17 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.8 mt-10 -60.06 -68.34 0.3 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.87 0.367 . . . . 0.0 111.495 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.517 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 41.4 t -56.77 -21.78 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.672 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.674 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.9 pt-20 -70.31 -45.95 65.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.413 ' N ' ' HG2' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -68.52 -17.15 64.1 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.241 -0.89 . . . . 0.0 108.961 177.136 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.517 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 0.4 OUTLIER -73.76 -75.23 0.16 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.529 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.3 mm? -60.62 -29.11 69.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.072 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.472 ' CB ' ' O ' ' A' ' 58' ' ' GLU . 3.5 tt0 -66.35 -38.2 87.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -66.83 -27.69 67.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -27.31 58.96 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.601 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.427 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 8.4 tm-20 -78.29 -30.06 48.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.403 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.42 -31.14 69.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.712 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.49 -10.77 45.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.226 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 63.41 143.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.787 0.327 . . . . 0.0 110.983 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 mt -93.84 -63.49 1.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.845 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 31.5 mt -147.0 33.53 0.91 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.482 HD11 HG22 ' A' ' 71' ' ' ILE . 23.6 mm -89.74 -58.81 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.218 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.3 112.24 46.7 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.975 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.51 -160.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.52 2.147 . . . . 0.0 112.285 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -134.56 162.1 33.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.348 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 56.52 -157.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.669 0.271 . . . . 0.0 110.927 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -78.41 -38.07 42.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.523 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.5 mt -46.94 114.47 0.85 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.076 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.476 ' HB3' ' HG ' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -130.72 106.28 8.36 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.13 0.49 . . . . 0.0 112.001 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.429 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -68.88 -39.2 79.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.615 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.91 -46.84 95.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.879 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.476 ' HG ' ' HB3' ' A' ' 78' ' ' ASP . 0.2 OUTLIER -78.95 -25.75 43.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.923 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -84.59 -18.39 35.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.329 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 32.3 mtm -107.92 -23.29 12.1 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.411 ' CB ' HD11 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -58.19 -75.0 0.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.8 0.334 . . . . 0.0 111.304 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -174.27 127.65 0.35 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.116 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -158.43 29.34 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.585 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -97.42 -15.34 20.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.266 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -70.6 -12.09 61.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.913 0.387 . . . . 0.0 111.163 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.443 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 11.2 mm -86.92 -57.51 4.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.523 ' O ' ' HB ' ' A' ' 94' ' ' THR . 40.0 tt0 -63.28 -19.21 64.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.179 177.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.426 ' O ' HG21 ' A' ' 94' ' ' THR . . . -83.27 -68.64 0.69 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.258 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 96' ' ' LEU . 1.3 tt -47.52 -28.27 2.16 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.118 0.485 . . . . 0.0 110.263 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 0.3 OUTLIER -83.25 -40.47 19.55 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.644 179.125 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 4.0 t -69.22 -9.53 53.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.889 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.94 -33.57 3.0 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.197 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.7 OUTLIER -87.77 -8.04 56.52 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 120.974 0.416 . . . . 0.0 111.058 179.282 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.425 ' CE1' ' HB ' ' B' ' 98' ' ' VAL . 0.3 OUTLIER 65.98 -152.66 0.24 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.297 -179.466 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.423 ' HB ' ' CE1' ' B' ' 97' ' ' PHE . 21.8 t . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 120.754 0.312 . . . . 0.0 111.114 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.703 0.287 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 63.58 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.419 ' O ' ' C ' ' B' ' 55' ' ' THR . 0.8 OUTLIER -94.74 -68.05 0.82 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.864 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.554 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 97.7 m 22.16 -86.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.8 mt-10 -60.0 -68.3 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 0.0 111.452 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.518 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 41.7 t -56.84 -21.74 14.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.658 -179.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.674 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.9 pt-20 -70.32 -46.0 65.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.406 ' N ' ' HG2' ' B' ' 58' ' ' GLU . 0.3 OUTLIER -68.39 -17.3 64.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.006 177.138 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.518 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 0.4 OUTLIER -73.74 -75.2 0.16 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.553 -179.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.3 mm? -60.38 -29.38 68.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.144 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.473 ' CB ' ' O ' ' B' ' 58' ' ' GLU . 3.6 tt0 -66.35 -38.09 86.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' B' ' 59' ' ' SER . 6.2 ttt85 -66.88 -27.76 67.77 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -27.29 59.1 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.544 0.687 . . . . 0.0 109.626 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.427 ' HB2' ' HB2' ' A' ' 65' ' ' GLU . 8.5 tm-20 -78.25 -30.12 48.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.382 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 -31.15 69.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.669 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.42 -10.8 45.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.353 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 63.56 143.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.814 0.34 . . . . 0.0 110.949 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.0 tp -93.49 -63.62 1.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.984 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 30.6 mt -146.83 33.55 0.93 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.855 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . 0.471 HG22 HD11 ' B' ' 71' ' ' ILE . 23.4 mm -89.71 -58.87 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.166 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.24 112.22 46.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.952 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.43 -160.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.527 2.151 . . . . 0.0 112.313 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -134.22 164.0 28.36 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -52.65 96.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.168 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 179.06 -38.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.259 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.9 tp 179.66 148.53 0.27 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.426 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . 0.456 ' HB3' ' HG ' ' B' ' 81' ' ' LEU . 0.6 OUTLIER -116.97 104.68 11.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.077 0.465 . . . . 0.0 110.808 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.429 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 0.0 OUTLIER -68.42 -39.06 81.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.621 -179.429 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -62.03 -46.78 95.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.456 ' HG ' ' HB3' ' B' ' 78' ' ' ASP . 0.2 OUTLIER -79.06 -25.54 43.13 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.0 -178.955 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 0.0 OUTLIER -84.84 -18.43 34.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.354 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 32.6 mtm -107.84 -23.18 12.16 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.39 -74.83 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.727 0.299 . . . . 0.0 111.257 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -174.43 127.71 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.194 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -158.41 28.93 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.613 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -96.89 -15.45 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.284 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -70.73 -12.01 61.3 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.077 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.428 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 11.2 mm -86.76 -57.65 4.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.533 ' O ' ' HB ' ' B' ' 94' ' ' THR . 40.0 tt0 -63.31 -19.19 64.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.187 177.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . 0.424 ' O ' HG21 ' B' ' 94' ' ' THR . . . -83.23 -68.63 0.69 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.345 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' B' ' 96' ' ' LEU . 1.3 tt -47.56 -28.33 2.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.959 0.409 . . . . 0.0 110.128 179.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER -83.18 -40.5 19.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.679 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.533 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 4.0 t -69.1 -9.67 53.84 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.841 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.98 -33.54 3.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.128 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 0.7 OUTLIER -87.83 -8.02 56.46 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.008 0.432 . . . . 0.0 111.104 179.286 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.423 ' CE1' ' HB ' ' A' ' 98' ' ' VAL . 0.4 OUTLIER 66.01 -152.74 0.24 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.214 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . 0.425 ' HB ' ' CE1' ' A' ' 97' ' ' PHE . 21.9 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 111.15 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.064 0 CA-C-O 120.891 0.377 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 64.99 74.39 0.39 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.143 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.468 ' HA ' ' CG1' ' B' ' 57' ' ' VAL . 1.5 mt -147.14 -96.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.522 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 0.2 OUTLIER 37.82 -142.73 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.099 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.71 -64.17 0.19 Allowed 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.465 ' CG1' ' HA ' ' B' ' 54' ' ' LEU . 34.0 t -50.45 -37.21 14.59 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.636 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.3 pt-20 -61.36 -48.09 82.9 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -66.27 -15.64 63.37 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.381 177.802 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.422 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 29.2 ttm-85 -72.96 -71.35 0.31 Allowed 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.554 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -64.58 -27.29 68.85 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.851 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.447 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 1.9 tt0 -68.58 -33.44 74.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.57 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.0 OUTLIER -81.4 -19.37 42.73 Favored 'General case' 0 C--O 1.231 0.102 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.452 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.407 HD22 ' N ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -82.98 -24.01 33.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.253 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' B' ' 65' ' ' GLU . 0.6 OUTLIER -93.93 -65.14 1.01 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.655 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.449 ' O ' ' CB ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.33 133.89 53.55 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.449 ' CB ' ' O ' ' A' ' 66' ' ' GLN . 0.5 OUTLIER 83.4 -45.73 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.777 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.65 88.7 3.29 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.969 0.414 . . . . 0.0 110.669 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.07 161.2 38.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.738 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.63 -19.49 58.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.273 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.7 mm -125.05 27.51 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.643 0.259 . . . . 0.0 111.633 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.417 ' CE2' ' HB2' ' A' ' 74' ' ' ARG . 5.1 p90 -58.04 137.29 84.03 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.006 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.468 2.112 . . . . 0.0 112.335 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.417 ' HB2' ' CE2' ' A' ' 72' ' ' PHE . 0.0 OUTLIER -169.06 -65.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -70.94 0.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 61.39 154.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.78 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 pp -150.11 26.64 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.136 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 62.56 69.52 0.6 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.935 0.397 . . . . 0.0 110.893 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 29.0 mtp -65.27 -49.16 70.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.692 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.0 mp -76.6 -41.19 34.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.15 -30.15 69.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.661 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.45 -29.75 18.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.392 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.81 -24.24 63.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.769 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.6 96.63 10.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.5 m -54.06 109.92 0.54 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.179 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 pp -139.39 26.39 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.56 -21.88 13.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -7.01 49.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 0.0 111.105 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.458 ' N ' ' CD1' ' A' ' 89' ' ' ILE . 2.6 mp -91.79 -54.05 7.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.63 -20.88 66.09 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.2 178.014 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -56.83 3.16 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.265 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.415 ' CB ' ' O ' ' A' ' 88' ' ' ASP . 32.8 tp -54.76 -24.09 20.91 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.2 mt -92.24 -39.53 11.48 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.544 179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.65 -13.85 61.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.146 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.11 -40.89 0.46 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.422 -0.894 . . . . 0.0 113.345 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.71 -0.44 16.0 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 30.4 p90 39.53 53.4 2.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.603 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.357 -179.86 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.817 0.342 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.06 74.4 0.39 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.033 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.465 ' HA ' ' CG1' ' A' ' 57' ' ' VAL . 1.5 mt -147.1 -96.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.5 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.525 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 0.2 OUTLIER 37.67 -142.77 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 179.077 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.67 -64.15 0.19 Allowed 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.468 ' CG1' ' HA ' ' A' ' 54' ' ' LEU . 34.6 t -50.6 -37.14 15.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.779 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.648 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.3 pt-20 -61.28 -48.09 83.02 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 0.2 OUTLIER -66.33 -15.46 63.27 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.521 177.762 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 28.8 ttm-85 -73.01 -71.26 0.31 Allowed 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.63 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -64.53 -27.45 68.97 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.842 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.441 ' HB2' ' CD1' ' A' ' 61' ' ' LEU . 1.9 tt0 -68.53 -33.52 74.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.503 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.0 OUTLIER -81.49 -19.2 42.78 Favored 'General case' 0 C--O 1.231 0.109 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.616 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.416 HD22 ' N ' ' B' ' 65' ' ' GLU . 0.0 OUTLIER -83.01 -23.95 33.05 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.244 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -94.06 -65.15 1.01 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.599 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 67' ' ' LEU . 0.0 OUTLIER -64.4 133.97 53.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.214 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.437 ' CB ' ' O ' ' B' ' 66' ' ' GLN . 0.5 OUTLIER 83.33 -45.74 0.12 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.756 -179.328 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.68 88.48 3.23 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.867 0.365 . . . . 0.0 110.586 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -158.11 160.09 36.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.59 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 14.7 mt -59.64 -19.56 50.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.273 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 15.7 mm -124.98 27.53 2.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.595 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . 0.419 ' CE2' ' HB2' ' B' ' 74' ' ' ARG . 5.1 p90 -58.04 137.34 84.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.966 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.568 2.179 . . . . 0.0 112.283 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . 0.419 ' HB2' ' CE2' ' B' ' 72' ' ' PHE . 0.0 OUTLIER -168.96 -65.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.114 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -125.31 122.83 37.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.19 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 p30 -66.89 173.73 3.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.789 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp 177.56 -30.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.177 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 64.17 69.24 0.53 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.902 0.382 . . . . 0.0 110.696 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 29.1 mtp -65.16 -49.3 70.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.675 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.0 mp -76.43 -41.25 35.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.15 -30.19 69.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.558 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.58 -29.7 18.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.296 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.76 -24.3 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.712 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.64 96.57 10.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.638 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 5.4 m -54.01 109.82 0.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 pp -139.43 26.67 2.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.992 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.74 -21.92 13.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.922 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' B' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -6.97 49.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.061 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.457 ' CD1' ' N ' ' B' ' 89' ' ' ILE . 2.6 mp -91.79 -54.03 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -20.8 66.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.237 177.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.35 -56.69 3.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.247 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.407 ' CB ' ' O ' ' B' ' 88' ' ' ASP . 33.4 tp -54.82 -24.1 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.97 0.414 . . . . 0.0 109.908 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 11.1 mt -92.28 -39.57 11.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.47 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.94 61.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.13 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.06 -40.84 0.47 Allowed Glycine 0 CA--C 1.519 0.3 0 C-N-CA 120.42 -0.895 . . . . 0.0 113.354 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.76 -0.45 15.95 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 30.0 p90 39.52 53.43 2.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.571 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.353 -179.857 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.928 0.394 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -116.75 -66.49 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.63 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.481 ' HA ' ' CG1' ' B' ' 57' ' ' VAL . 5.0 mp -54.62 -81.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.409 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 13.2 t 42.72 -151.19 0.03 OUTLIER 'General case' 0 C--O 1.24 0.576 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 178.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 15.1 mt-10 -38.02 -41.46 0.56 Allowed 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.575 -178.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.49 ' CG1' ' HA ' ' B' ' 54' ' ' LEU . 51.6 t -64.44 -42.74 96.16 Favored 'Isoleucine or valine' 0 C--O 1.251 1.143 0 CA-C-O 121.362 0.601 . . . . 0.0 110.922 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.567 ' CA ' HD21 ' B' ' 61' ' ' LEU . 1.1 pt-20 -59.04 -54.5 46.34 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.503 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 94.0 p -61.67 -17.56 56.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.657 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.443 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.8 -71.49 0.22 Allowed 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.871 -179.115 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.566 HD21 ' CA ' ' B' ' 58' ' ' GLU . 0.0 OUTLIER -67.8 -19.97 65.14 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.787 -179.335 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.462 ' HB2' HD22 ' B' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.21 77.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.901 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.6 mtp85 -85.78 -18.66 32.34 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.215 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -75.85 -34.22 60.06 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.144 0.497 . . . . 0.0 110.407 179.639 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.493 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 0.5 OUTLIER -96.49 -28.84 14.22 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.129 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.03 42.31 3.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.127 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.31 119.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.26 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.459 ' HB2' ' CD2' ' B' ' 68' ' ' PHE . 4.0 t80 -151.4 124.0 8.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.985 0.422 . . . . 0.0 110.971 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tp -175.23 -39.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.07 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -103.82 26.01 9.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.416 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 21.6 mt -114.01 -24.87 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.173 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 63.45 123.36 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.732 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -84.17 87.11 1.19 Allowed 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.683 2.255 . . . . 0.0 112.654 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.7 mtp-105 56.47 34.12 23.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.243 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.85 104.54 14.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 75.4 -76.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.6 mp 53.95 68.2 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.026 0.441 . . . . 0.0 110.88 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -114.3 -19.02 11.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.674 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.1 -40.81 74.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.742 0.306 . . . . 0.0 111.045 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mm -67.3 -44.11 87.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.117 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.27 -24.3 67.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.921 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.07 -26.81 22.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.937 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 39.7 mtp -85.17 -20.28 30.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.101 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -99.5 28.02 4.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.77 0.319 . . . . 0.0 110.98 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 168.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.061 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.5 mt -176.09 -40.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.897 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.92 -30.62 22.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.811 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.06 -9.93 58.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.169 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.466 ' N ' ' CD1' ' A' ' 89' ' ' ILE . 2.4 mp -91.65 -55.97 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.54 -20.9 65.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.524 -0.762 . . . . 0.0 108.982 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.2 -49.98 6.91 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.883 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.4 mt -53.97 -26.75 27.43 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.425 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 3.8 mm? -91.9 -36.88 13.22 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.997 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.19 -14.82 57.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.964 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.47 -29.79 1.26 Allowed Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.498 -0.858 . . . . 0.0 113.21 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -100.12 2.87 43.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.962 0.381 . . . . 0.0 111.956 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.425 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 24.5 p90 -38.89 137.54 0.65 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.679 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.991 179.937 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.834 0.349 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -116.71 -66.27 1.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.725 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.49 ' HA ' ' CG1' ' A' ' 57' ' ' VAL . 5.0 mp -54.72 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.726 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.406 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 13.3 t 42.81 -151.25 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -38.04 -41.37 0.56 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.613 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.481 ' CG1' ' HA ' ' A' ' 54' ' ' LEU . 52.5 t -64.46 -42.87 96.52 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.297 0.57 . . . . 0.0 110.798 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.566 ' CA ' HD21 ' A' ' 61' ' ' LEU . 1.1 pt-20 -58.97 -54.65 44.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.509 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 94.1 p -61.47 -17.73 55.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.728 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.438 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.65 -71.63 0.21 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.857 -179.132 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.567 HD21 ' CA ' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -67.69 -19.97 65.23 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.834 -179.281 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.473 ' HB2' HD22 ' A' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.25 77.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.886 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.6 mtp85 -85.7 -18.69 32.38 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.169 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.53 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -75.88 -34.16 59.99 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.14 0.495 . . . . 0.0 110.365 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 0.5 OUTLIER -96.64 -28.78 14.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.115 179.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 65.83 42.47 3.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.22 118.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . 0.459 ' CD2' ' HB2' ' A' ' 68' ' ' PHE . 4.0 t80 -151.28 123.64 8.34 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.024 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -174.75 -39.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.075 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mt -104.16 26.14 9.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.159 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . 0.415 ' HB ' ' CE1' ' B' ' 68' ' ' PHE . 21.4 mt -113.98 -24.82 3.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.246 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 63.54 123.28 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.696 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -84.3 86.92 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.778 2.318 . . . . 0.0 112.552 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.0 mtp-105 53.88 24.45 4.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.805 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -83.79 -73.55 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.342 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.91 88.16 2.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.937 0.398 . . . . 0.0 110.755 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.63 67.97 0.92 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -105.64 -19.8 13.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -40.75 75.29 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 34.9 mm -67.34 -44.2 87.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.018 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mp -65.33 -24.09 67.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.19 -26.82 22.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.98 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 39.8 mtp -85.1 -20.37 30.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.15 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -99.48 28.13 4.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.073 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t 57.45 168.05 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -176.06 -40.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.926 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.75 -30.74 22.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.91 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.89 -10.13 59.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.459 ' CD1' ' N ' ' B' ' 89' ' ' ILE . 2.5 mp -91.57 -56.01 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -62.52 -20.9 65.08 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.045 177.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 -49.92 6.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.0 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 4.4 mt -54.01 -26.74 27.77 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.429 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 3.8 mm? -91.84 -36.92 13.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.013 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.12 -14.87 57.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.986 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.41 -29.96 1.24 Allowed Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.199 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -100.04 2.87 43.76 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.429 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 24.4 p90 -38.82 137.5 0.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.643 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.929 179.991 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.81 0.338 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -126.62 85.38 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.776 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.509 ' O ' ' N ' ' A' ' 56' ' ' GLU . 19.6 tp -172.7 -100.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.017 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.493 ' C ' ' O ' ' A' ' 54' ' ' LEU . 38.4 m 6.35 -72.75 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -59.96 -68.52 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.997 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.491 ' CG1' ' HB ' ' B' ' 57' ' ' VAL . 24.5 t -55.53 -48.56 77.2 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.587 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.2 pt-20 -51.72 -47.29 64.06 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.387 0.613 . . . . 0.0 109.469 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.414 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 4.9 t -67.61 -19.51 65.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.577 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -69.21 -68.53 0.4 Allowed 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.466 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.645 ' HG ' ' HB2' ' B' ' 62' ' ' GLU . 3.6 mm? -62.91 -42.46 99.8 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.802 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.623 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 69.7 tt0 -50.8 -35.96 34.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.255 177.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.45 -26.59 46.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.913 0.387 . . . . 0.0 110.035 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -27.16 68.3 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.3 0.571 . . . . 0.0 109.742 179.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 66' ' ' GLN . 25.2 tt0 -99.56 -21.23 15.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.882 178.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 65' ' ' GLU . 17.3 pt20 50.53 35.26 10.92 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.482 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.445 ' O ' ' CB ' ' A' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 11.0 7.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.925 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.457 ' CE1' ' CD2' ' B' ' 69' ' ' LEU . 0.4 OUTLIER 158.58 137.69 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.471 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.453 ' HG ' ' CG2' ' A' ' 71' ' ' ILE . 0.7 OUTLIER -66.42 -165.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.34 179.458 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.74 -15.51 58.74 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.453 ' CG2' ' HG ' ' A' ' 69' ' ' LEU . 0.7 OUTLIER -57.18 -28.86 30.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.716 0.293 . . . . 0.0 111.539 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.19 92.95 5.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.164 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.75 -7.6 21.04 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.579 2.186 . . . . 0.0 112.663 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 65.9 49.71 1.61 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.351 . . . . 0.0 110.918 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -176.27 -51.04 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -108.59 135.07 50.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.961 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 pp -109.36 30.12 6.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.96 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 30.54 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -49.72 57.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.9 mm -61.72 -45.51 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.989 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 mt -66.11 -30.4 70.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.524 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -74.86 -28.97 60.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.855 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.03 -73.93 0.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.577 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.39 116.4 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.624 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 75.49 -161.93 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.777 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 64.92 26.07 12.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.751 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -148.94 -40.88 0.15 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.912 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.22 -8.3 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.881 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.449 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 13.0 mm -89.36 -56.87 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.479 ' O ' ' HB ' ' A' ' 94' ' ' THR . 2.5 tm-20 -64.89 -19.88 66.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.493 178.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.41 ' HA ' ' CG2' ' A' ' 94' ' ' THR . . . -87.48 -58.74 2.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.641 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 25.5 tp -55.85 -24.27 35.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.289 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 1.0 OUTLIER -92.38 -39.79 11.25 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.066 179.668 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.479 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 11.4 t -69.94 -11.49 60.91 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.898 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.33 -35.85 1.06 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.753 -0.737 . . . . 0.0 113.19 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.71 -5.42 42.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 117.015 0.408 . . . . 0.0 112.015 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.426 ' CD2' ' O ' ' A' ' 97' ' ' PHE . 25.6 p90 37.26 93.97 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.033 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 12.2 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.184 179.743 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.835 0.35 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -126.54 85.43 2.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' B' ' 56' ' ' GLU . 19.7 tp -172.81 -100.37 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.028 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.483 ' C ' ' O ' ' B' ' 54' ' ' LEU . 38.9 m 6.46 -72.87 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -59.95 -68.53 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.007 -178.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.491 ' HB ' ' CG1' ' A' ' 57' ' ' VAL . 25.0 t -55.68 -48.17 78.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.714 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.609 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 pt-20 -52.01 -47.28 65.04 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.425 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 4.8 t -67.41 -19.56 65.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.666 178.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -69.26 -68.59 0.39 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.426 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.623 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 3.6 mm? -62.9 -42.43 99.78 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 119.377 -0.929 . . . . 0.0 108.742 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.645 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 69.7 tt0 -50.85 -35.83 34.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.249 177.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.6 -26.57 45.43 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.918 0.39 . . . . 0.0 110.014 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -27.2 68.37 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.336 0.588 . . . . 0.0 109.723 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.423 ' O ' ' CG ' ' B' ' 66' ' ' GLN . 25.3 tt0 -99.54 -21.35 15.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.837 178.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' B' ' 65' ' ' GLU . 17.3 pt20 50.53 35.32 11.07 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.47 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.45 ' O ' ' CB ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 10.8 7.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.958 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . 0.45 ' CB ' ' O ' ' B' ' 67' ' ' LEU . 0.3 OUTLIER 158.78 138.61 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.632 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.457 ' CD2' ' CE1' ' A' ' 68' ' ' PHE . 2.4 tp -66.06 -166.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.439 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 15.8 mt -63.7 -15.44 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.345 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.24 -28.66 30.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.715 0.293 . . . . 0.0 111.549 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.28 93.09 5.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.169 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.82 -7.63 21.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.62 2.213 . . . . 0.0 112.695 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 65.74 49.27 1.75 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.922 0.391 . . . . 0.0 110.836 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -170.64 -61.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.835 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -105.35 139.47 39.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.754 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.03 34.16 3.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.5 30.41 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -49.75 56.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 38.0 mm -61.72 -45.49 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mt -66.05 -30.39 70.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.585 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -75.0 -28.82 60.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.04 -73.92 0.43 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.651 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.36 116.35 10.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.597 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 75.67 -162.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.692 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 mm? 64.85 26.18 12.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.847 0.356 . . . . 0.0 110.723 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -148.96 -40.91 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.802 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.27 -8.16 51.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.884 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.45 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 12.9 mm -89.37 -56.96 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.485 ' O ' ' HB ' ' B' ' 94' ' ' THR . 2.4 tm-20 -64.93 -19.91 66.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.432 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . 0.416 ' HA ' ' CG2' ' B' ' 94' ' ' THR . . . -87.33 -58.69 2.49 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.78 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 25.8 tp -55.8 -24.36 35.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.288 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 1.0 OUTLIER -92.25 -39.89 11.27 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.08 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.485 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 11.5 t -69.97 -11.47 60.9 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.895 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.4 -35.89 1.05 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.106 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.62 -5.39 42.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 117.162 0.481 . . . . 0.0 112.105 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.431 ' CD2' ' O ' ' B' ' 97' ' ' PHE . 25.9 p90 37.25 94.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.13 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . 0.402 ' CG1' ' CD2' ' B' ' 93' ' ' LEU . 12.1 p . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.19 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.793 0.33 . . . . 0.0 111.328 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -157.27 27.46 0.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.431 HD11 ' N ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -101.13 -0.46 36.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.59 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.508 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -56.32 -53.41 57.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.79 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.14 -42.05 63.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.459 ' HB ' ' CG1' ' B' ' 57' ' ' VAL . 2.9 t -62.59 -41.1 90.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.628 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.572 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 2.4 mt-10 -56.61 -64.1 0.98 Allowed 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.6 m -52.88 -20.51 3.37 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.118 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.451 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.01 -73.25 0.15 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.159 -179.31 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.6 mm? -61.83 -24.42 66.88 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.145 -1.022 . . . . 0.0 110.208 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.404 ' HB2' HD13 ' B' ' 61' ' ' LEU . 24.3 tt0 -65.28 -37.19 86.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.49 177.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -20.39 53.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.522 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.515 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -74.47 -32.07 62.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.46 0.647 . . . . 0.0 110.386 179.404 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.446 ' CB ' ' CB ' ' B' ' 65' ' ' GLU . 3.3 mm-40 -92.81 -23.71 18.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.623 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -58.74 -39.03 79.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.017 0.437 . . . . 0.0 110.366 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 tt -76.46 -11.42 59.88 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.969 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 31.5 t80 76.57 130.93 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.91 0.386 . . . . 0.0 111.123 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -145.15 61.04 1.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.737 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.7 52.47 13.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.149 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.405 ' CD1' ' HG2' ' B' ' 66' ' ' GLN . 6.5 tp -99.43 -41.08 9.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.097 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -78.57 113.52 35.31 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.836 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.1 134.36 59.73 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.361 2.041 . . . . 0.0 112.255 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.6 mtm180 -156.38 89.01 1.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -73.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -95.51 121.57 37.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.226 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp 53.9 100.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.128 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.421 ' CB ' ' CD2' ' A' ' 81' ' ' LEU . 13.1 m-20 -75.69 96.3 3.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 28.5 mtt -62.5 -25.82 68.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.901 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.03 -55.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.403 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.421 ' CD2' ' CB ' ' A' ' 78' ' ' ASP . 0.4 OUTLIER -81.52 -15.68 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -179.874 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.37 -25.98 38.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.814 0.34 . . . . 0.0 110.744 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.54 -22.86 12.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.89 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.04 -68.46 0.44 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.746 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 p -147.88 -92.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.96 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 12.8 tp 44.78 29.78 0.47 Allowed 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 120.783 0.325 . . . . 0.0 111.414 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.77 -33.42 1.82 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.361 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.77 -10.29 57.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.668 0.27 . . . . 0.0 111.242 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 21.3 mm -88.71 -53.89 8.76 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.436 ' O ' ' HB ' ' A' ' 94' ' ' THR . 33.2 tt0 -67.49 -16.81 64.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.184 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.451 ' HA ' ' CG2' ' A' ' 94' ' ' THR . . . -88.02 -47.86 8.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.212 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 10.4 mt -64.08 -24.19 67.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.159 0.504 . . . . 0.0 109.756 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.443 ' HB3' ' HB3' ' B' ' 93' ' ' LEU . 1.3 mm? -91.26 -36.85 13.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.795 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.451 ' CG2' ' HA ' ' A' ' 91' ' ' ALA . 9.0 t -75.51 -13.02 60.35 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.0 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.65 -31.11 1.86 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.251 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.96 -0.11 12.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 117.151 0.475 . . . . 0.0 112.144 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.511 ' CD1' ' N ' ' A' ' 97' ' ' PHE . 0.1 OUTLIER 36.14 -92.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.279 179.485 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.252 -179.935 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.843 0.354 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -157.28 27.46 0.3 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.986 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.432 HD11 ' N ' ' B' ' 55' ' ' THR . 0.0 OUTLIER -101.25 -0.44 35.81 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.605 -179.876 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.505 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -56.33 -53.38 57.94 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.204 0.526 . . . . 0.0 110.778 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.16 -42.13 63.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.662 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.459 ' CG1' ' HB ' ' A' ' 57' ' ' VAL . 2.9 t -62.65 -40.96 90.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.646 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 2.4 mt-10 -56.66 -64.03 1.0 Allowed 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 43.5 m -52.93 -20.45 3.38 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.138 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.446 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.13 -73.14 0.15 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.156 -179.331 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.6 mm? -61.9 -24.34 66.89 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.2 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -65.5 -37.05 85.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -20.4 53.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.566 178.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.534 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -74.63 -31.95 62.14 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.36 0.6 . . . . 0.0 110.328 179.506 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.446 ' CB ' ' CB ' ' A' ' 65' ' ' GLU . 3.3 mm-40 -92.81 -23.62 18.78 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.718 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 0.405 ' HG2' ' CD1' ' A' ' 71' ' ' ILE . 7.6 mt-30 -58.77 -39.16 80.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.309 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 9.2 tt -76.43 -11.41 59.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.025 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 31.3 t80 76.48 130.99 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.877 0.37 . . . . 0.0 111.216 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.48 60.98 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.0 52.46 12.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.5 tp -99.37 -41.07 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.248 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -78.48 113.54 35.26 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.905 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.05 134.17 58.64 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.416 2.078 . . . . 0.0 112.266 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -155.85 87.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.798 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -163.67 102.33 0.92 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.468 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 66.45 127.08 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.471 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.74 69.56 0.5 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.02 0.438 . . . . 0.0 110.704 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . 0.412 ' CB ' ' CD2' ' B' ' 81' ' ' LEU . 12.9 m-20 -72.02 97.25 1.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.643 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 28.2 mtt -62.64 -25.7 68.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.1 -55.77 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.346 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.412 ' CD2' ' CB ' ' B' ' 78' ' ' ASP . 0.4 OUTLIER -81.71 -15.53 54.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.484 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.41 -26.01 38.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.788 0.327 . . . . 0.0 110.75 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.53 -22.82 12.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.0 -68.57 0.43 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.715 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 p -147.86 -92.2 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.91 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 9.1 tp 44.82 29.76 0.48 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.79 0.328 . . . . 0.0 111.358 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.92 -33.35 1.79 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.387 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.72 -10.33 57.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.34 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 20.9 mm -88.48 -53.9 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.426 ' O ' ' HB ' ' B' ' 94' ' ' THR . 33.2 tt0 -67.65 -16.78 64.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.185 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . 0.448 ' HA ' ' CG2' ' B' ' 94' ' ' THR . . . -88.0 -47.73 8.31 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.332 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.21 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.135 0.493 . . . . 0.0 109.713 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 93' ' ' LEU . 1.3 mm? -91.29 -36.95 13.58 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.773 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.448 ' CG2' ' HA ' ' B' ' 91' ' ' ALA . 9.1 t -75.44 -13.1 60.37 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.033 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.59 -31.04 1.88 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.398 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.9 -0.11 12.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 117.154 0.477 . . . . 0.0 112.273 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.516 ' N ' ' CD1' ' B' ' 97' ' ' PHE . 0.1 OUTLIER 36.05 -92.87 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.272 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--N 1.332 -0.155 0 CA-C-O 120.844 0.354 . . . . 0.0 111.308 -179.904 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.822 0.344 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -144.87 136.97 25.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.034 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.462 ' O ' ' N ' ' A' ' 57' ' ' VAL . 5.0 mp -110.5 -57.52 2.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.618 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.423 ' C ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -21.04 -55.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 1.7 mm-40 -58.68 -50.84 72.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.266 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.547 ' HB ' ' HB ' ' B' ' 57' ' ' VAL . 6.1 t -63.92 -53.81 39.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.39 -179.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HB2' HD23 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.58 -62.39 1.68 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.437 ' HA ' HD21 ' B' ' 61' ' ' LEU . 29.9 t -48.72 -28.03 3.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.64 177.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 8.7 tpt180 -60.74 -63.86 1.15 Allowed 'General case' 0 C--O 1.242 0.694 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.889 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.751 HD21 ' HB2' ' B' ' 62' ' ' GLU . 1.0 OUTLIER -63.03 -18.22 63.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 118.1 -1.44 . . . . 0.0 109.71 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.759 ' HB2' HD21 ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.34 -37.66 87.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.722 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -68.91 -31.6 70.62 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.523 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -63.21 -30.15 71.35 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.086 177.67 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.408 ' N ' HD22 ' A' ' 64' ' ' LEU . 0.6 OUTLIER -80.18 -31.44 38.81 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.049 179.159 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -55.74 -35.93 66.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.56 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.01 -29.99 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.524 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.58 102.96 0.78 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.772 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.1 -72.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.26 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.9 mt -140.48 53.48 1.62 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.85 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 7.1 tt 42.84 32.18 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.54 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.15 67.49 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.2 163.91 1.42 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.523 2.149 . . . . 0.0 112.35 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.21 89.34 7.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -159.96 152.08 20.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -80.87 90.18 5.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.9 mp -118.91 175.36 5.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.793 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.431 ' HB2' ' HB2' ' A' ' 81' ' ' LEU . 7.0 p-10 -137.08 59.71 1.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -45.92 77.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.015 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -57.16 -39.79 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.861 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.431 ' HB2' ' HB2' ' A' ' 78' ' ' ASP . 9.3 mp -71.38 -27.91 63.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.788 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.16 -23.3 44.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 16.4 mtp -95.96 -21.11 18.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.247 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.57 -2.74 37.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.412 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.55 143.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.946 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 9.7 tp -149.62 26.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.958 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -116.14 -15.96 11.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.287 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.46 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 67.4 m-20 -71.08 -10.06 59.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.649 0.262 . . . . 0.0 111.22 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 20.2 mm -89.68 -55.36 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.47 ' O ' ' HB ' ' A' ' 94' ' ' THR . 20.0 tt0 -66.23 -17.58 64.83 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.275 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.415 ' HA ' ' CG2' ' A' ' 94' ' ' THR . . . -87.94 -55.35 3.8 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.555 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 3.2 mm? -58.98 -23.44 61.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.115 0.483 . . . . 0.0 110.051 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.43 -40.92 11.15 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.046 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.47 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 10.5 t -71.01 -11.73 61.13 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.226 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.71 -33.64 1.27 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.122 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.01 -2.86 33.4 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.41 ' CD2' ' O ' ' A' ' 97' ' ' PHE . 17.6 p90 40.35 79.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.688 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.109 -179.963 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.745 0.307 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -144.85 137.02 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.043 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.459 ' O ' ' N ' ' B' ' 57' ' ' VAL . 5.0 mp -110.54 -57.51 2.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.641 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.434 ' C ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -20.98 -55.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 179.977 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 1.7 mm-40 -58.7 -50.86 72.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.841 0.353 . . . . 0.0 111.287 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.547 ' HB ' ' HB ' ' A' ' 57' ' ' VAL . 6.1 t -63.8 -53.84 39.43 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.428 ' O ' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.56 -62.4 1.68 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.429 ' HA ' HD21 ' A' ' 61' ' ' LEU . 30.1 t -48.73 -28.14 3.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.567 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.527 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 8.7 tpt180 -60.6 -63.83 1.16 Allowed 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.991 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.759 HD21 ' HB2' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -63.18 -18.07 63.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.111 -1.436 . . . . 0.0 109.808 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.751 ' HB2' HD21 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -65.38 -37.67 87.71 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 175.616 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -68.96 -31.52 70.45 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.544 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -63.16 -30.29 71.47 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.05 177.653 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.413 ' N ' HD22 ' B' ' 64' ' ' LEU . 0.6 OUTLIER -80.21 -31.32 38.68 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.638 -1.165 . . . . 0.0 110.125 179.147 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -55.86 -35.87 66.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.563 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -29.87 63.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.541 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.64 103.2 0.83 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.647 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 43.7 tp -54.26 -72.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.23 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 4.8 mt -140.36 53.46 1.63 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.907 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 7.1 tt 42.88 32.1 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.651 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.11 67.58 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.927 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.27 163.92 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.596 2.197 . . . . 0.0 112.28 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.15 89.32 7.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -159.98 151.51 19.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.75 90.07 5.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.58 175.96 5.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 6.9 p-10 -137.33 59.69 1.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.857 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -45.83 77.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.091 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.7 mm -57.14 -39.83 69.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.433 ' HB2' ' HB2' ' B' ' 78' ' ' ASP . 9.3 mp -71.32 -27.99 63.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.753 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.1 -23.38 44.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.162 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 16.3 mtp -95.93 -21.13 18.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.186 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.5 -2.83 37.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.378 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.53 144.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.829 0.347 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -149.8 26.02 0.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.952 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -115.92 -16.13 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.276 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 67.7 m-20 -70.99 -10.08 59.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.736 0.303 . . . . 0.0 111.261 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 20.1 mm -89.63 -55.42 6.3 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.459 ' O ' ' HB ' ' B' ' 94' ' ' THR . 20.0 tt0 -66.13 -17.78 64.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.217 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . 0.418 ' HA ' ' CG2' ' B' ' 94' ' ' THR . . . -87.92 -55.33 3.81 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.553 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 3.2 mm? -59.05 -23.44 62.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.48 -40.8 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.968 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.459 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 10.6 t -71.16 -11.7 61.08 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.138 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.73 -33.72 1.26 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.756 -0.735 . . . . 0.0 113.044 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.07 -2.8 33.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 117.002 0.401 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.411 ' CD2' ' O ' ' B' ' 97' ' ' PHE . 17.6 p90 40.46 79.55 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.671 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.163 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.757 0.313 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.44 ' CD2' ' CB ' ' B' ' 56' ' ' GLU . 0.2 OUTLIER -145.49 76.61 1.48 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.096 -179.493 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 56' ' ' GLU . 0.5 OUTLIER -177.65 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 116.719 -0.218 . . . . 0.0 111.13 -179.623 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.446 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.2 m 24.8 -85.3 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.435 ' CB ' ' CD2' ' B' ' 53' ' ' HIS . 4.0 mm-40 -62.74 -68.03 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.893 0.378 . . . . 0.0 111.744 -178.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.519 ' CG1' ' HB ' ' B' ' 57' ' ' VAL . 1.9 t -55.94 -44.55 78.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.289 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.699 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.1 pt-20 -52.98 -48.19 67.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.452 0.644 . . . . 0.0 109.452 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 27.8 t -66.39 -20.16 65.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.636 178.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 2.2 tpm_? -70.01 -71.73 0.23 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.832 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.683 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.5 mm? -61.21 -38.77 87.77 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.245 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.541 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 8.0 tt0 -53.41 -39.44 64.32 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.795 176.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.1 OUTLIER -70.25 -28.54 65.32 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.865 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.575 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.35 68.92 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 68' ' ' PHE . 30.0 tt0 -88.63 -25.48 22.4 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.355 178.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.27 -76.73 0.06 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.924 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.36 42.09 1.87 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.422 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.456 ' HA ' ' HG2' ' A' ' 65' ' ' GLU . 31.7 p90 -39.46 104.84 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.988 0.423 . . . . 0.0 111.546 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.91 -66.69 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.789 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 71.3 mt -150.27 -79.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.989 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.92 24.65 4.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.378 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.96 91.02 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.011 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.25 108.51 2.0 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.531 2.154 . . . . 0.0 112.304 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.04 146.89 32.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 55.97 177.72 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.078 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -125.12 37.45 4.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.88 35.38 1.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.856 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.21 20.33 15.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.99 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.15 -28.69 66.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 110.679 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 26.9 mm -79.46 -45.72 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.43 -24.65 63.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.191 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.27 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.913 0.387 . . . . 0.0 110.891 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 44.4 mtp -57.98 -25.39 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.258 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.03 -59.02 0.45 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.035 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 m 64.53 -163.42 0.26 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.801 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 mt 70.41 30.28 3.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.33 -53.07 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.699 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.5 m-20 -70.5 -11.43 60.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.919 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 26.4 mm -90.3 -52.06 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.476 ' O ' ' HB ' ' A' ' 94' ' ' THR . 1.5 tt0 -66.02 -17.95 65.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.033 177.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.43 ' HA ' ' CG2' ' A' ' 94' ' ' THR . . . -87.89 -53.6 4.67 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.583 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.422 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 6.1 mp -61.13 -21.22 63.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.054 0.454 . . . . 0.0 110.156 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.429 ' HB3' ' HB3' ' B' ' 93' ' ' LEU . 7.5 mp -94.52 -38.45 10.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.862 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.476 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 12.3 t -72.28 -13.47 61.51 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.909 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.36 -32.32 1.06 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.146 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.472 ' O ' ' CG ' ' A' ' 97' ' ' PHE . 0.4 OUTLIER -115.67 5.59 14.31 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.518 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.472 ' CG ' ' O ' ' A' ' 96' ' ' LEU . 39.0 p90 46.22 -145.21 0.21 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.355 -179.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 12.4 p . . . . . 0 C--N 1.327 -0.391 0 CA-C-O 120.855 0.359 . . . . 0.0 111.166 -179.867 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.716 0.293 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . 0.435 ' CD2' ' CB ' ' A' ' 56' ' ' GLU . 0.2 OUTLIER -145.32 76.71 1.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.989 -179.476 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.427 ' O ' ' N ' ' B' ' 56' ' ' GLU . 0.5 OUTLIER -177.72 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.151 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.3 m 24.93 -85.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.44 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 4.0 mm-40 -62.84 -67.97 0.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.873 0.368 . . . . 0.0 111.705 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.519 ' HB ' ' CG1' ' A' ' 57' ' ' VAL . 1.9 t -55.9 -44.71 78.83 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.177 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.683 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.1 pt-20 -52.9 -48.23 67.36 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.429 0.633 . . . . 0.0 109.49 179.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.468 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 28.0 t -66.29 -20.24 66.05 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.61 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -69.97 -71.71 0.23 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.891 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.5 mm? -61.3 -38.7 87.75 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.427 -0.909 . . . . 0.0 109.169 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.532 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 8.0 tt0 -53.56 -39.32 64.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.765 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.1 OUTLIER -70.26 -28.59 65.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.563 ' HB3' ' O ' ' B' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.43 68.97 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.508 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.45 ' HG2' ' HA ' ' B' ' 68' ' ' PHE . 29.6 tt0 -88.43 -25.65 22.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.45 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -76.83 0.06 Allowed 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.815 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.43 42.21 1.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.35 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . 0.45 ' HA ' ' HG2' ' B' ' 65' ' ' GLU . 31.8 p90 -39.43 104.73 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.859 0.361 . . . . 0.0 111.593 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 8.0 tt -145.91 -66.32 0.3 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.891 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 71.7 mt -150.49 -79.43 0.12 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.88 24.6 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.316 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.98 90.96 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.007 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -69.36 108.57 2.03 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.358 2.039 . . . . 0.0 112.273 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.98 146.92 32.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.963 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -57.95 88.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 p30 -131.07 23.38 4.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.82 89.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.227 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -113.9 20.09 16.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.83 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.2 -28.74 66.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.657 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 26.6 mm -79.28 -45.94 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.858 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.26 -24.66 64.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.29 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.24 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 44.6 mtp -57.94 -25.47 60.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.226 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.05 -59.11 0.45 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.781 0.324 . . . . 0.0 111.019 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 m 64.68 -163.48 0.26 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.829 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 70.34 30.21 3.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.08 -53.04 0.91 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.728 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.5 m-20 -70.56 -11.42 60.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.881 0.372 . . . . 0.0 110.934 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 26.5 mm -90.3 -52.0 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.468 ' O ' ' HB ' ' B' ' 94' ' ' THR . 1.5 tt0 -66.02 -17.87 64.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.086 177.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . 0.431 ' HA ' ' CG2' ' B' ' 94' ' ' THR . . . -87.92 -53.66 4.63 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.588 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 6.1 mp -61.02 -21.35 63.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.423 . . . . 0.0 110.0 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.429 ' HB3' ' HB3' ' A' ' 93' ' ' LEU . 7.5 mp -94.62 -38.33 10.9 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 12.4 t -72.29 -13.43 61.5 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.889 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.32 -32.36 1.06 Allowed Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.151 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.478 ' O ' ' CG ' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -115.64 5.59 14.34 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.478 ' CG ' ' O ' ' B' ' 96' ' ' LEU . 39.0 p90 46.34 -145.28 0.22 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.327 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 120.814 0.34 . . . . 0.0 111.22 -179.978 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.871 0.367 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.451 ' CD2' ' NE2' ' B' ' 53' ' ' HIS . 3.1 t-160 -62.06 83.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.454 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.442 ' O ' ' HB3' ' A' ' 58' ' ' GLU . 2.3 tp 179.79 -33.55 0.01 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.656 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.579 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 5.1 m -45.23 -80.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -35.02 -65.44 0.22 Allowed 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.527 ' CG1' ' HB ' ' B' ' 57' ' ' VAL . 4.3 t -52.86 -28.99 14.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.234 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.654 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.7 pt-20 -64.92 -48.75 73.02 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.424 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 53.1 p -64.54 -18.61 64.99 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.47 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -75.61 0.12 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.078 -179.709 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.6 mm? -59.97 -29.72 68.62 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.032 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.52 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 19.6 tt0 -62.89 -39.5 94.7 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.081 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.56 -15.55 58.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.754 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.41 ' CD1' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -85.64 -24.28 27.16 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.421 -179.547 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.442 ' CG ' ' HB3' ' B' ' 65' ' ' GLU . 0.1 OUTLIER -104.46 -21.9 13.39 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.78 -179.573 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.52 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 0.0 OUTLIER -84.43 2.01 42.71 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.264 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tp -114.09 -35.13 5.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 110.916 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -141.61 166.91 23.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.971 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.9 mt 58.95 55.73 4.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.053 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -129.19 -85.36 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.56 17.38 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.605 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.82 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.886 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.83 118.0 5.21 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.402 2.068 . . . . 0.0 112.339 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -161.86 162.27 29.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.808 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -144.54 133.21 22.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.915 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -177.64 -46.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.887 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 64.32 126.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.055 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.18 46.48 7.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.017 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 27.8 mtp -70.07 -41.18 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.749 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 12.5 mm -63.5 -51.33 71.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.834 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.405 HD22 ' CG2' ' B' ' 80' ' ' ILE . 0.9 OUTLIER -66.14 -29.03 69.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.854 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.9 -30.0 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.992 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.3 -21.6 24.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.05 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.83 102.72 15.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.901 0.382 . . . . 0.0 110.78 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.59 87.03 1.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.48 -17.98 11.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -71.4 -8.89 56.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.526 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 68.3 m-20 -73.1 -9.85 59.17 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.798 0.333 . . . . 0.0 110.995 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.425 HD11 HG22 ' A' ' 89' ' ' ILE . 7.4 mm -88.6 -53.0 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 94' ' ' THR . 1.6 tt0 -67.02 -20.7 65.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.911 178.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.25 -67.43 0.8 Allowed 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.409 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 1.1 tt -52.05 -23.74 5.69 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.02 0.438 . . . . 0.0 110.389 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 97' ' ' PHE . 8.1 tt -87.77 -38.43 15.77 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.532 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.405 ' CB ' ' O ' ' A' ' 90' ' ' GLU . 3.8 m -72.76 -10.89 60.32 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.87 -30.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.477 -0.868 . . . . 0.0 113.788 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.06 4.88 3.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' A' ' 93' ' ' LEU . 22.7 p90 40.3 70.57 0.23 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.575 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 13.8 p . . . . . 0 C--O 1.233 0.212 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.863 179.983 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.88 0.371 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . 0.451 ' NE2' ' CD2' ' A' ' 53' ' ' HIS . 3.2 t-160 -62.04 83.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.53 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.446 ' O ' ' HB3' ' B' ' 58' ' ' GLU . 2.3 tp 179.84 -33.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.755 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.581 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 5.0 m -45.15 -80.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -34.91 -65.53 0.21 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.527 ' HB ' ' CG1' ' A' ' 57' ' ' VAL . 4.3 t -52.88 -28.94 14.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.165 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.635 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.7 pt-20 -64.98 -48.62 73.34 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 53.0 p -64.67 -18.55 65.08 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.486 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -75.54 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.067 -179.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.6 mm? -60.02 -29.71 68.68 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.948 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.525 ' O ' ' HB2' ' B' ' 66' ' ' GLN . 19.6 tt0 -62.79 -39.67 94.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.132 177.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.54 -15.48 58.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.716 178.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.416 ' CD1' HD12 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -85.68 -24.4 27.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.906 0.384 . . . . 0.0 111.339 -179.591 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.442 ' HB3' ' CG ' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -104.47 -21.83 13.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 0.525 ' HB2' ' O ' ' B' ' 62' ' ' GLU . 0.0 OUTLIER -84.53 2.2 42.27 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.298 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.409 HD21 ' CD2' ' B' ' 68' ' ' PHE . 6.0 tp -114.07 -35.18 5.14 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.833 0.349 . . . . 0.0 110.95 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . 0.409 ' CD2' HD21 ' B' ' 67' ' ' LEU . 46.7 m-85 -141.58 166.9 23.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.035 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 mp 58.95 55.56 4.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.093 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -128.98 -85.41 0.56 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.817 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.57 17.5 4.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.586 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.93 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.726 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.85 117.87 5.11 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.508 2.139 . . . . 0.0 112.349 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -161.31 160.39 29.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.826 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -119.44 -165.17 1.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.922 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.59 101.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.77 164.15 18.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.77 46.49 8.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.816 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 27.9 mtp -69.92 -41.28 74.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.719 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.405 ' CG2' HD22 ' A' ' 81' ' ' LEU . 12.4 mm -63.44 -51.35 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.17 -28.95 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.873 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.85 -30.18 62.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.972 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.24 -21.59 24.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.064 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.78 102.8 15.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.865 0.364 . . . . 0.0 110.744 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.69 87.12 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.01 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 mp -114.41 -18.19 11.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.269 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -71.36 -8.82 56.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.523 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 68.4 m-20 -73.02 -9.97 59.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.803 0.335 . . . . 0.0 111.04 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.41 HD11 HG22 ' B' ' 89' ' ' ILE . 7.4 mm -88.64 -53.03 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.422 ' N ' HG23 ' A' ' 89' ' ' ILE . 1.6 tt0 -66.96 -20.71 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.947 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.18 -67.44 0.79 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.529 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 1.1 tt -51.96 -23.91 5.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.979 0.419 . . . . 0.0 110.309 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 8.1 tt -87.72 -38.38 15.86 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.554 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.401 ' CB ' ' O ' ' B' ' 90' ' ' GLU . 3.8 m -72.73 -10.91 60.35 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.155 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.92 -30.23 1.66 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.433 -0.889 . . . . 0.0 113.645 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.09 4.97 3.01 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.406 ' CD2' ' O ' ' B' ' 97' ' ' PHE . 22.8 p90 40.26 70.48 0.24 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.878 0.37 . . . . 0.0 111.618 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 CA--C 1.53 0.193 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.81 179.889 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.828 0.347 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 179.05 57.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.634 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' A' ' 56' ' ' GLU . 0.3 OUTLIER -136.35 -51.49 0.7 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.873 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 54' ' ' LEU . 92.3 m 15.2 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.477 ' N ' ' O ' ' A' ' 54' ' ' LEU . 8.4 pt-20 -64.96 -55.95 16.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.632 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.547 ' CG1' ' HB ' ' B' ' 57' ' ' VAL . 4.6 t -59.6 -50.0 81.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-O 120.524 0.202 . . . . 0.0 111.454 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.761 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -53.11 -49.67 66.03 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.5 t -61.65 -21.43 64.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.589 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.454 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 0.7 OUTLIER -71.26 -73.17 0.19 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.311 -179.337 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.751 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -60.85 -27.1 67.85 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.129 -178.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 1.8 tt0 -66.83 -38.81 87.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.376 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.402 ' CG ' ' CD2' ' A' ' 67' ' ' LEU . 45.2 ttp180 -83.54 -9.18 59.11 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.78 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -91.83 -27.41 17.98 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.03 0.443 . . . . 0.0 111.254 -179.079 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.814 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 1.4 tp10 -113.5 -48.3 2.95 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 8.4 tt0 -47.0 -43.82 19.71 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.402 ' CD2' ' CG ' ' A' ' 63' ' ' ARG . 3.3 pp -97.49 22.7 8.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.775 0.321 . . . . 0.0 111.038 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -135.65 96.3 3.42 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 110.649 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -154.97 158.7 39.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.619 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 31.3 mt -49.74 -28.18 5.8 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.826 0.345 . . . . 0.0 111.064 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 34.1 mm -67.32 -14.33 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.275 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.21 106.12 0.59 Allowed Pre-proline 0 C--N 1.332 -0.183 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.8 127.0 13.93 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.403 2.069 . . . . 0.0 112.336 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.27 -40.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.864 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -131.49 177.28 7.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -110.78 75.91 0.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.014 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.25 -39.66 62.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.77 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -146.69 93.77 2.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.868 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.16 -24.48 64.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.081 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.0 mm -63.31 -56.3 18.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.365 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' B' ' 81' ' ' LEU . 0.4 OUTLIER -82.89 -10.45 58.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.599 -179.657 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -88.19 -27.3 21.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.55 0.214 . . . . 0.0 111.263 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -16.25 12.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.536 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.57 -66.3 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.795 0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.59 -171.32 0.19 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.187 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -168.08 -43.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.786 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.873 ' O ' ' N ' ' A' ' 89' ' ' ILE . 38.1 mtt180 -107.89 -67.94 0.93 Allowed 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.826 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.411 ' N ' ' HB1' ' A' ' 91' ' ' ALA . 1.6 m-20 21.53 -59.39 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.873 ' N ' ' O ' ' A' ' 87' ' ' ARG . 19.9 mm -84.27 -58.24 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 87' ' ' ARG . 3.4 tm-20 -66.13 -12.06 53.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.347 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.416 ' O ' HG21 ' A' ' 94' ' ' THR . . . -87.22 -57.09 3.09 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.172 0.511 . . . . 0.0 110.054 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 0.1 OUTLIER -60.26 -21.28 61.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.869 178.884 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 mt -93.34 -35.43 13.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 12.8 t -75.61 -12.26 60.18 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.66 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.03 -29.44 1.81 Allowed Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.206 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.88 2.17 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.494 ' CD1' ' N ' ' A' ' 97' ' ' PHE . 0.1 OUTLIER 37.67 -93.1 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.167 179.638 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 20.1 t . . . . . 0 C--N 1.33 -0.269 0 CA-C-O 120.779 0.323 . . . . 0.0 111.238 -179.992 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.812 0.339 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 179.02 57.45 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' B' ' 56' ' ' GLU . 0.3 OUTLIER -136.24 -51.47 0.71 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.9 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.449 ' C ' ' O ' ' B' ' 54' ' ' LEU . 92.2 m 15.16 -79.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' B' ' 54' ' ' LEU . 8.4 pt-20 -65.06 -55.85 16.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.601 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.547 ' HB ' ' CG1' ' A' ' 57' ' ' VAL . 4.5 t -59.59 -50.0 81.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-O 120.538 0.208 . . . . 0.0 111.461 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.751 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -53.06 -49.68 65.87 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.347 0.594 . . . . 0.0 109.522 179.073 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 12.4 t -61.8 -21.34 64.51 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.511 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.442 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 0.7 OUTLIER -71.38 -73.2 0.19 Allowed 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.417 -0.811 . . . . 0.0 112.267 -179.301 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.761 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -60.84 -26.91 67.69 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.207 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' B' ' 66' ' ' GLN . 1.8 tt0 -66.89 -38.82 86.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.317 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 -83.43 -9.35 59.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.808 179.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.513 HD11 ' O ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -91.82 -27.42 17.99 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.01 0.433 . . . . 0.0 111.271 -179.032 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.814 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.4 tp10 -113.53 -48.24 2.95 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . 0.446 ' HB2' ' O ' ' B' ' 62' ' ' GLU . 8.4 tt0 -46.99 -43.69 19.55 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 pp -97.56 22.71 8.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.724 0.297 . . . . 0.0 111.003 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -135.6 97.15 3.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.861 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -156.12 160.93 40.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.814 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 31.9 mt -51.12 -28.46 10.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 33.9 mm -67.34 -14.17 17.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.391 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.18 106.02 0.57 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.236 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.66 127.05 14.11 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.41 2.074 . . . . 0.0 112.387 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.16 -39.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.855 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.99 -176.32 3.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -78.52 -69.92 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.94 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.6 mt 68.82 -68.1 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -147.19 94.05 2.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.913 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.25 -24.51 64.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.09 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 39.3 mm -63.38 -56.17 18.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.315 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -82.97 -10.5 58.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.689 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -88.07 -27.33 22.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.685 0.279 . . . . 0.0 111.404 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.51 -16.18 12.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.621 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.5 -66.36 0.29 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.777 0.322 . . . . 0.0 111.012 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.7 -171.26 0.19 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.974 0.416 . . . . 0.0 111.026 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -168.15 -43.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.763 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.872 ' O ' ' N ' ' B' ' 89' ' ' ILE . 38.7 mtt180 -108.23 -67.9 0.94 Allowed 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.769 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . 0.415 ' N ' ' HB1' ' B' ' 91' ' ' ALA . 1.6 m-20 21.71 -59.54 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.872 ' N ' ' O ' ' B' ' 87' ' ' ARG . 20.4 mm -84.33 -58.22 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.478 ' N ' ' O ' ' B' ' 87' ' ' ARG . 3.4 tm-20 -66.0 -12.19 53.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.392 177.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . 0.415 ' HB1' ' N ' ' B' ' 88' ' ' ASP . . . -87.15 -57.03 3.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.138 0.494 . . . . 0.0 110.084 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 0.1 OUTLIER -60.15 -21.29 61.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.985 178.78 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 mt -93.32 -35.52 13.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.929 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.475 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 12.6 t -75.53 -12.26 60.19 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.752 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.04 -29.55 1.78 Allowed Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.722 -0.752 . . . . 0.0 113.137 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.78 2.16 11.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.504 ' N ' ' CD1' ' B' ' 97' ' ' PHE . 0.1 OUTLIER 37.78 -93.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.022 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 20.0 t . . . . . 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 0.0 111.27 -179.941 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.584 0.23 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 59.76 111.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.875 0.369 . . . . 0.0 110.889 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.551 ' O ' ' HB3' ' A' ' 58' ' ' GLU . 1.3 mt -119.15 -17.15 9.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.811 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.518 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 92.7 m -53.6 -84.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.29 -60.93 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' B' ' 54' ' ' LEU . 3.3 t -56.73 -39.33 63.06 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 120.918 0.389 . . . . 0.0 111.842 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HB3' ' O ' ' A' ' 54' ' ' LEU . 1.3 pt-20 -58.52 -55.06 39.96 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.478 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 31.4 t -63.53 -14.91 55.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.623 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.492 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 1.7 ttt180 -70.83 -74.03 0.16 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.493 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.581 ' CD2' ' HB2' ' B' ' 62' ' ' GLU . 0.1 OUTLIER -66.17 -20.02 66.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 117.772 -1.571 . . . . 0.0 109.702 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.592 ' HB2' ' CD2' ' B' ' 61' ' ' LEU . 11.0 tm-20 -64.4 -38.5 91.25 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 175.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -70.91 -29.35 65.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.863 177.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.43 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -67.47 -28.39 67.82 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.804 178.411 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -83.71 -31.28 26.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.249 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -29.08 68.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.28 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 68' ' ' PHE . 7.3 mt -84.06 -12.18 55.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.019 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.464 ' CE1' ' CG2' ' A' ' 71' ' ' ILE . 83.8 t80 65.54 95.22 0.06 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.873 0.368 . . . . 0.0 110.775 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.22 157.42 37.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.967 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 54.08 21.65 3.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.68 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.466 HD11 HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -120.96 -48.61 2.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.672 0.273 . . . . 0.0 110.827 179.715 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.432 ' N ' ' CG2' ' A' ' 71' ' ' ILE . 4.6 m-85 55.84 165.57 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.861 0.363 . . . . 0.0 111.262 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -78.19 126.07 7.53 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.642 2.228 . . . . 0.0 112.263 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.06 -30.58 11.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.993 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -91.98 166.71 12.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.949 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -107.82 -43.12 4.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 mp 63.49 140.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -109.84 -26.29 9.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.46 -29.1 61.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.073 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -65.14 -66.47 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.881 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.22 -19.35 54.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -81.23 -31.53 33.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.802 0.334 . . . . 0.0 111.027 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.4 ptm -92.6 -13.44 29.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.573 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.18 51.73 2.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 111.423 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.0 m 44.92 93.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.573 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -115.9 -28.67 6.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.166 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.34 -11.5 59.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.494 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.48 -10.43 59.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.718 0.294 . . . . 0.0 111.295 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.8 mm -89.58 -55.52 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.42 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.465 ' O ' ' HB ' ' A' ' 94' ' ' THR . 38.1 tt0 -66.32 -17.91 65.04 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.303 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.443 ' HA ' ' CG2' ' A' ' 94' ' ' THR . . . -88.24 -53.42 4.71 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.453 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 16.8 mt -58.76 -25.22 62.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.973 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.99 -39.38 11.7 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.067 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.465 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 10.7 t -70.94 -11.78 61.16 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.008 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.76 -34.76 1.23 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.958 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.402 ' C ' ' CD1' ' A' ' 97' ' ' PHE . 0.1 OUTLIER -98.36 -2.27 39.68 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.945 0.372 . . . . 0.0 111.914 -179.672 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.402 ' CD1' ' C ' ' A' ' 96' ' ' LEU . 3.4 p90 40.5 -125.94 0.45 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.277 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.332 -0.159 0 CA-C-O 120.803 0.335 . . . . 0.0 111.229 -179.928 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.706 0.289 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 59.93 111.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.867 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.558 ' O ' ' HB3' ' B' ' 58' ' ' GLU . 1.3 mt -119.21 -17.29 8.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.796 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.524 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 92.5 m -53.53 -84.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.32 -60.97 0.17 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.492 HG23 ' HA ' ' A' ' 54' ' ' LEU . 3.2 t -56.62 -39.33 62.16 Favored 'Isoleucine or valine' 0 C--O 1.25 1.08 0 CA-C-O 120.939 0.399 . . . . 0.0 111.93 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.558 ' HB3' ' O ' ' B' ' 54' ' ' LEU . 1.2 pt-20 -58.58 -55.06 39.89 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.485 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 31.2 t -63.49 -15.01 56.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.618 177.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.477 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 1.7 ttt180 -70.62 -74.19 0.15 Allowed 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.495 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.592 ' CD2' ' HB2' ' A' ' 62' ' ' GLU . 0.1 OUTLIER -66.15 -19.97 66.0 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 117.703 -1.599 . . . . 0.0 109.651 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.581 ' HB2' ' CD2' ' A' ' 61' ' ' LEU . 11.1 tm-20 -64.45 -38.5 91.23 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -70.92 -29.21 65.19 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.909 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.454 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.1 OUTLIER -67.54 -28.46 67.83 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.697 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -83.71 -31.35 26.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.093 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -29.09 68.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.262 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 7.3 mt -83.95 -12.18 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . 0.46 ' CE1' ' CG2' ' B' ' 71' ' ' ILE . 83.7 t80 65.58 95.14 0.06 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.801 0.334 . . . . 0.0 110.713 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.25 157.32 37.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 54.15 21.78 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.588 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . 0.465 HG22 HD11 ' B' ' 71' ' ' ILE . 0.0 OUTLIER -120.97 -48.64 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.611 0.243 . . . . 0.0 110.839 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . 0.436 ' N ' ' CG2' ' B' ' 71' ' ' ILE . 4.6 m-85 55.77 165.66 0.06 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.277 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.34 126.16 7.47 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.541 2.161 . . . . 0.0 112.268 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.05 -30.63 11.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.997 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -92.1 167.24 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -108.26 -42.96 4.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.926 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.2 mt 63.52 140.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.985 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -109.89 -26.28 9.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -29.21 61.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.016 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.6 mm -64.98 -66.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.973 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.3 -19.39 54.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.135 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -80.96 -31.69 34.77 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.823 0.344 . . . . 0.0 111.121 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 25.5 ptm -92.63 -13.38 29.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.568 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.25 51.75 2.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.781 0.324 . . . . 0.0 111.39 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 6.1 m 45.01 93.05 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.484 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tp -115.82 -28.79 6.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.044 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.36 -11.41 59.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.548 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.51 -10.43 59.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 0.0 111.309 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 17.2 mm -89.66 -55.59 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.454 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.468 ' O ' ' HB ' ' B' ' 94' ' ' THR . 38.2 tt0 -66.11 -18.05 65.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.278 177.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . 0.46 ' HA ' ' CG2' ' B' ' 94' ' ' THR . . . -88.23 -53.39 4.72 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.507 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 16.8 mt -58.77 -25.19 62.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.076 0.465 . . . . 0.0 110.083 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.93 -39.45 11.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.117 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 10.8 t -70.91 -11.88 61.22 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.942 179.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.67 -34.73 1.24 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.002 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.406 ' C ' ' CD1' ' B' ' 97' ' ' PHE . 0.1 OUTLIER -98.44 -2.09 39.85 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.758 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' B' ' 96' ' ' LEU . 3.4 p90 40.54 -125.93 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.304 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.332 -0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.998 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.445 ' O ' ' CG ' ' A' ' 53' ' ' HIS . . . . . . . . 0 CA--C 1.533 0.321 0 N-CA-C 110.905 -0.035 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 52' ' ' ALA . 21.2 p80 43.58 30.06 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.753 0.311 . . . . 0.0 111.456 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.67 -32.59 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.404 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 1.7 m -75.59 -41.25 55.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.441 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.8 -40.97 63.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.928 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.563 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 2.8 t -71.89 -40.94 69.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 120.975 0.417 . . . . 0.0 110.839 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.752 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 24.5 pt-20 -62.63 -48.15 80.64 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.42 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 3.5 m -63.42 -22.67 67.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.309 177.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.563 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 2.7 mtt-85 -68.54 -71.68 0.21 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.671 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.0 mm? -61.37 -24.79 66.73 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.844 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.466 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.05 -37.02 86.21 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.69 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -31.13 68.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.866 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.48 -27.77 66.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.293 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.471 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 2.2 tm-20 -80.88 -31.58 35.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.473 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.02 -49.47 65.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.76 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 pp -63.0 -26.98 69.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.916 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.416 ' CZ ' ' HB2' ' B' ' 72' ' ' PHE . 2.1 m-85 64.68 160.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.934 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.94 88.22 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.795 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.473 ' O ' HG21 ' A' ' 71' ' ' ILE . 0.7 OUTLIER 51.57 51.67 16.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.473 HG21 ' O ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER 41.82 31.35 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.897 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.419 ' HB2' ' CZ ' ' B' ' 68' ' ' PHE . 10.9 t80 68.31 100.96 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.62 -174.87 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.684 2.256 . . . . 0.0 112.169 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 66.5 -73.88 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.9 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 66.79 6.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.653 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.64 -46.28 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.028 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 tp 60.78 159.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.722 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -136.06 19.81 3.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.168 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -35.4 63.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.833 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.2 mp -64.01 -46.02 95.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.929 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.08 -27.88 54.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.895 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -27.84 62.55 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.81 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 13.5 ptp -95.64 -25.04 16.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.094 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.59 -50.45 9.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.7 p -178.93 130.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.977 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -175.89 -57.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.807 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -80.11 -28.45 38.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.789 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -72.75 -9.41 58.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.849 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.43 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 17.4 mm -89.66 -54.74 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.51 ' O ' ' HB ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -64.51 -21.11 66.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.197 177.799 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.407 ' O ' HG21 ' A' ' 94' ' ' THR . . . -86.42 -67.34 0.82 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.717 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 96' ' ' LEU . 71.6 mt -49.01 -26.61 2.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.063 0.459 . . . . 0.0 110.413 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 97' ' ' PHE . 1.0 OUTLIER -87.87 -44.01 11.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.978 179.672 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.51 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 9.8 t -67.79 -8.27 34.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.583 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.71 -29.73 1.65 Allowed Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.022 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.2 OUTLIER -100.43 -1.65 35.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.864 0.364 . . . . 0.0 111.96 -179.609 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.468 ' O ' ' CG1' ' A' ' 98' ' ' VAL . 73.9 t80 -65.85 -57.4 8.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.625 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.468 ' CG1' ' O ' ' A' ' 97' ' ' PHE . 9.9 p . . . . . 0 CA--C 1.53 0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.139 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' B' ' 53' ' ' HIS . . . . . . . . 0 CA--C 1.533 0.319 0 N-CA-C 110.953 -0.017 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . 0.437 ' CG ' ' O ' ' B' ' 52' ' ' ALA . 21.3 p80 43.65 29.98 0.32 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.825 0.345 . . . . 0.0 111.535 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.65 -32.6 0.69 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 1.8 m -75.66 -41.23 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.75 -41.01 63.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.922 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.558 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 2.8 t -71.92 -40.83 68.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.083 0.468 . . . . 0.0 110.888 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.739 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.5 pt-20 -62.8 -47.98 81.11 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.418 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 3.5 m -63.52 -22.61 66.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.347 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.558 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 2.7 mtt-85 -68.47 -71.65 0.21 Allowed 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.791 -179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.0 mm? -61.27 -24.91 66.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 119.173 -1.011 . . . . 0.0 109.858 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.464 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -64.96 -37.2 86.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.713 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -31.13 69.03 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.033 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.37 -27.81 66.57 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.349 178.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.471 ' HB2' ' HB2' ' A' ' 65' ' ' GLU . 2.2 tm-20 -80.97 -31.48 34.78 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.414 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -49.58 64.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.795 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 pp -62.89 -27.0 69.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.939 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . 0.419 ' CZ ' ' HB2' ' A' ' 72' ' ' PHE . 2.1 m-85 64.64 160.53 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 10.2 tt -143.75 88.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.792 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.474 ' O ' HG21 ' B' ' 71' ' ' ILE . 0.7 OUTLIER 51.39 51.72 16.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.076 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . 0.474 HG21 ' O ' ' B' ' 70' ' ' LEU . 0.5 OUTLIER 41.83 31.34 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.869 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 68' ' ' PHE . 10.9 t80 68.32 100.78 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.062 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.45 -174.76 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.638 2.226 . . . . 0.0 112.236 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 66.36 -74.37 0.06 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.051 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.82 -69.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.944 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -66.86 0.24 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp 60.03 166.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.952 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -136.15 19.87 3.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.088 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -35.42 63.24 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.864 0.364 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 3.2 mp -64.06 -45.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.907 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.26 -27.89 53.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.777 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -27.79 62.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.814 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 13.5 ptp -95.64 -25.07 16.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.023 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.57 -50.42 10.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.974 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 13.7 p -178.91 130.12 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.828 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -175.91 -57.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.827 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -80.25 -28.43 38.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.758 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.65 -9.45 58.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.843 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.423 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 17.0 mm -89.56 -54.75 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.511 ' O ' ' HB ' ' B' ' 94' ' ' THR . 0.0 OUTLIER -64.48 -21.18 66.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.191 177.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . 0.402 ' O ' HG21 ' B' ' 94' ' ' THR . . . -86.48 -67.22 0.83 Allowed 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.733 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' B' ' 96' ' ' LEU . 71.5 mt -49.06 -26.65 2.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.13 0.491 . . . . 0.0 110.399 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' B' ' 97' ' ' PHE . 1.0 OUTLIER -87.77 -44.15 11.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.007 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 9.7 t -67.75 -8.2 33.62 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.549 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.72 -29.74 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.62 -0.8 . . . . 0.0 113.062 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 0.2 OUTLIER -100.45 -1.65 35.27 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.963 0.381 . . . . 0.0 111.936 -179.663 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.465 ' O ' ' CG1' ' B' ' 98' ' ' VAL . 74.4 t80 -65.82 -57.38 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.681 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . 0.465 ' CG1' ' O ' ' B' ' 97' ' ' PHE . 10.0 p . . . . . 0 CA--C 1.53 0.191 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.151 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.901 0.381 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.7 p-80 -134.24 147.25 50.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.828 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.427 ' CB ' ' HB3' ' A' ' 58' ' ' GLU . 0.5 OUTLIER -136.31 -53.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.575 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.606 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.1 m 21.5 -86.31 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -68.31 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.974 0.416 . . . . 0.0 111.324 -179.251 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.575 ' HA ' ' HB2' ' A' ' 60' ' ' ARG . 22.6 t -53.82 -27.97 16.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.726 -179.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.698 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -66.55 -46.8 74.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.189 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.02 -17.33 64.38 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.575 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -73.72 0.17 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.663 -179.805 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.684 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.1 mm? -62.35 -32.35 73.12 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.69 -179.364 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.456 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 3.4 tt0 -61.29 -36.31 79.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.199 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -81.09 -16.1 54.09 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.989 0.423 . . . . 0.0 110.023 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.519 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -79.12 -27.19 42.83 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.376 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.53 ' HG3' ' HG3' ' B' ' 65' ' ' GLU . 7.6 mm-40 -102.86 -21.6 13.99 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.125 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.61 -36.07 83.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.962 0.411 . . . . 0.0 110.171 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -83.27 -0.35 49.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.742 179.384 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 73.1 m-85 67.4 -96.65 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.067 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 47.21 28.0 0.92 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.696 0.284 . . . . 0.0 111.155 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.8 mt -154.7 -45.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.161 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.454 HD11 HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.43 46.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.093 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . 0.48 ' O ' ' CG ' ' A' ' 72' ' ' PHE . 10.6 p90 -123.28 74.42 50.76 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.939 0.4 . . . . 0.0 110.866 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.54 16.62 1.88 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.818 2.345 . . . . 0.0 112.867 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.64 -58.32 2.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.839 0.352 . . . . 0.0 111.028 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 59.0 27.79 16.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -153.67 -53.09 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.793 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.6 pp -120.39 -173.45 2.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.808 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.538 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 3.0 m-20 -137.49 93.96 2.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.763 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.5 -38.88 88.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.881 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 42.5 mm -73.51 -43.26 55.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' B' ' 81' ' ' LEU . 1.7 mm? -74.18 -22.29 59.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.252 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -90.35 -27.71 19.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.872 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.84 -23.91 25.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.062 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.423 ' CB ' ' HG ' ' B' ' 81' ' ' LEU . 12.8 m-20 -103.92 104.15 14.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.04 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.3 m 60.85 113.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.972 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tp -178.45 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.027 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.69 -25.04 17.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.046 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.47 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -70.24 -10.16 58.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.301 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 17.1 mm -90.73 -56.79 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.55 ' O ' ' HB ' ' A' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.22 64.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.22 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.402 ' O ' HG21 ' A' ' 94' ' ' THR . . . -86.96 -56.11 3.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.252 179.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 3.1 mm? -51.74 -26.27 9.14 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 0.3 OUTLIER -90.46 -38.51 13.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 2.1 t -67.33 -11.22 57.07 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.1 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.25 -28.6 1.62 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.486 -0.864 . . . . 0.0 113.052 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.93 2.4 35.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . 0.432 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 29.3 p90 -41.05 137.64 1.24 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.556 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.2 p . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.096 179.939 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.944 0.402 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -134.39 147.11 50.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.43 ' CB ' ' HB3' ' B' ' 58' ' ' GLU . 0.5 OUTLIER -136.28 -52.83 0.73 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.671 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.604 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 97.3 m 21.28 -86.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 179.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.29 -68.24 0.3 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.889 0.376 . . . . 0.0 111.312 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.584 ' HA ' ' HB2' ' B' ' 60' ' ' ARG . 23.1 t -53.86 -28.01 16.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.687 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.684 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -66.42 -46.84 75.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.135 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.92 -17.42 64.45 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.584 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -73.75 0.17 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.737 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.698 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.1 mm? -62.17 -32.36 72.97 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.49 -0.884 . . . . 0.0 109.851 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.452 ' CB ' ' O ' ' B' ' 58' ' ' GLU . 3.5 tt0 -61.39 -36.23 79.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.249 177.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -81.08 -16.12 54.05 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.047 0.451 . . . . 0.0 110.014 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.538 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -79.17 -27.12 42.64 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.336 179.941 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.53 ' HG3' ' HG3' ' A' ' 65' ' ' GLU . 7.6 mm-40 -102.84 -21.66 13.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.109 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.63 -36.16 83.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.944 0.402 . . . . 0.0 110.065 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -0.45 49.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.799 179.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 67.41 -96.42 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.107 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 tt 47.06 27.98 0.84 Allowed 'General case' 0 CA--C 1.528 0.103 0 CA-C-O 120.71 0.291 . . . . 0.0 111.272 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 98.1 mt -154.81 -45.8 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.152 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . 0.471 HG22 HD11 ' B' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.083 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . 0.473 ' CG ' ' O ' ' B' ' 72' ' ' PHE . 10.6 p90 -123.25 74.46 50.56 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-O 120.963 0.411 . . . . 0.0 110.851 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -87.53 16.54 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.905 2.403 . . . . 0.0 112.898 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.68 -58.15 2.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.841 0.353 . . . . 0.0 110.941 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.07 29.91 19.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 -158.4 -50.61 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.776 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -120.15 -177.82 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.822 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . 0.535 ' HB3' ' HB2' ' B' ' 81' ' ' LEU . 3.0 m-20 -135.61 93.28 2.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.631 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.37 -38.86 88.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.928 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 42.5 mm -73.56 -43.2 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.55 ' HA ' HD11 ' A' ' 81' ' ' LEU . 1.7 mm? -74.17 -22.29 59.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.264 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -90.37 -27.68 19.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.867 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.98 25.08 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.998 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . 0.429 ' CB ' ' HG ' ' A' ' 81' ' ' LEU . 12.7 m-20 -103.86 104.26 14.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.959 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 58.4 m 60.71 112.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.866 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -177.45 -39.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.952 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.23 -24.93 17.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.134 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . 0.486 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.0 OUTLIER -70.19 -10.15 57.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.391 179.875 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 17.1 mm -90.8 -56.73 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.19 64.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.263 177.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.05 -56.09 3.53 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.201 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.486 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 3.1 mm? -51.72 -26.15 8.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 0.3 OUTLIER -90.6 -38.58 13.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.676 179.408 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.547 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 2.1 t -67.2 -11.34 57.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.075 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.31 -28.44 1.64 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.552 -0.833 . . . . 0.0 113.053 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.0 2.37 34.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . 0.432 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 29.2 p90 -41.14 137.77 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.561 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.923 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.886 0.374 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' B' ' 53' ' ' HIS . 2.5 m-70 -92.52 127.4 38.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.165 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.49 ' O ' ' C ' ' A' ' 55' ' ' THR . 6.3 tp -174.11 -90.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.003 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.585 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.6 m 3.02 -100.29 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -35.97 -69.92 0.1 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.462 HG23 ' HA ' ' B' ' 54' ' ' LEU . 5.1 t -46.66 -29.93 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.553 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.611 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.4 pt-20 -66.88 -48.25 69.33 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 2.1 m -65.86 -14.63 61.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.201 177.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.03 -75.95 0.19 Allowed 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.835 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.684 ' HB2' ' HB2' ' B' ' 61' ' ' LEU . 3.9 mm? -60.36 -25.3 65.75 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.803 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.495 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 11.4 tt0 -73.13 -37.08 66.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.0 mmt180 -58.82 -39.99 82.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.488 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.522 HD22 ' HA ' ' A' ' 61' ' ' LEU . 1.2 pp -78.46 -23.28 46.6 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.238 178.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.495 ' HB3' ' HA ' ' A' ' 62' ' ' GLU . 1.2 tp10 -65.68 -34.56 78.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.475 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -28.18 62.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.422 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.454 ' C ' ' CG ' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -92.68 -0.36 57.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.256 179.849 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.454 ' CG ' ' C ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER 47.13 -88.81 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.592 179.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 67' ' ' LEU . 3.6 tp 64.26 24.69 13.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.684 0.278 . . . . 0.0 110.894 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.5 mt -148.79 -48.55 0.15 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.8 mp -82.82 -34.22 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.185 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.83 92.52 4.4 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.98 -170.37 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.471 2.114 . . . . 0.0 112.34 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -145.82 85.07 1.68 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.251 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.13 164.49 14.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.585 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.56 49.61 1.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -179.73 148.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.009 179.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.501 ' HB2' ' HB2' ' A' ' 81' ' ' LEU . 1.2 p30 -86.97 79.8 8.63 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -50.65 -28.01 8.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.25 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 21.0 mt -76.7 -60.3 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.953 0.406 . . . . 0.0 110.732 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.501 ' HB2' ' HB2' ' A' ' 78' ' ' ASP . 2.3 mm? -54.68 -19.56 6.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.764 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.55 -25.11 13.33 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.1 mmm -98.94 -2.01 38.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.51 87.98 2.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.389 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.06 -156.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 63.26 29.63 15.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.835 0.35 . . . . 0.0 110.936 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.15 -42.33 1.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.608 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.499 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 17.4 t70 -70.71 -9.54 57.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.051 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.441 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 2.6 mp -88.66 -56.09 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -19.97 65.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.259 177.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.9 -63.74 1.27 Allowed 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.65 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.499 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 1.2 tt -51.54 -24.41 5.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.947 0.403 . . . . 0.0 110.431 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 3.8 mm? -90.12 -40.99 11.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.485 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.79 -13.63 59.81 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.167 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.28 -50.23 0.31 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.228 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.4 ' N ' ' CD2' ' A' ' 96' ' ' LEU . 2.6 mm? -98.12 -2.48 39.91 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.24 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.92 32.96 0.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.834 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 18.3 t . . . . . 0 C--N 1.33 -0.279 0 CA-C-O 120.931 0.396 . . . . 0.0 111.266 -179.811 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.118 0 CA-C-O 120.851 0.358 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 53' ' ' HIS . 2.5 m-70 -92.74 127.43 38.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.075 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' LEU . . . . . 0.494 ' O ' ' C ' ' B' ' 55' ' ' THR . 6.3 tp -174.08 -90.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.031 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.59 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 98.8 m 3.17 -100.37 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -35.7 -70.15 0.09 Allowed 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' VAL . . . . . 0.479 HG23 ' HA ' ' A' ' 54' ' ' LEU . 5.3 t -46.68 -30.06 1.26 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.571 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.404 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.4 pt-20 -66.71 -48.34 69.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' SER . . . . . 0.472 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 2.1 m -65.73 -14.62 61.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.288 177.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.402 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -77.02 -75.97 0.19 Allowed 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.798 -179.603 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . 0.684 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 3.9 mm? -60.39 -25.31 65.81 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 119.74 -0.784 . . . . 0.0 109.793 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.489 ' HA ' ' HB3' ' B' ' 65' ' ' GLU . 11.3 tt0 -73.05 -37.18 66.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . 0.472 ' HB2' ' O ' ' B' ' 59' ' ' SER . 1.9 mmt180 -58.89 -39.9 82.8 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.542 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.504 HD22 ' HA ' ' B' ' 61' ' ' LEU . 1.2 pp -78.44 -23.33 46.66 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.272 178.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . 0.489 ' HB3' ' HA ' ' B' ' 62' ' ' GLU . 1.1 tp10 -65.64 -34.58 78.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.479 178.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.57 -28.18 62.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.402 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.444 ' C ' ' CG ' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -92.65 -0.23 57.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.266 179.803 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 46.96 -88.79 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.504 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.442 ' N ' ' O ' ' B' ' 67' ' ' LEU . 0.2 OUTLIER 64.19 24.81 13.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.694 0.283 . . . . 0.0 110.943 -179.849 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 mt -148.86 -48.65 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.91 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 3.8 mp -82.86 -34.0 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.26 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.95 92.47 4.46 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -68.9 -170.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.46 2.107 . . . . 0.0 112.411 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -146.76 81.04 1.55 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.543 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' B' ' 77' ' ' LEU . 3.6 mt-10 -119.96 12.79 12.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.638 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 66.12 -73.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.752 0.311 . . . . 0.0 110.889 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' B' ' 75' ' ' GLU . 0.5 OUTLIER -49.48 149.4 2.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.902 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' ASP . . . . . 0.501 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 1.4 p30 -93.42 79.52 4.39 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.096 0.474 . . . . 0.0 111.464 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -51.33 -27.79 10.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.062 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 20.9 mt -76.69 -60.24 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.95 0.405 . . . . 0.0 110.755 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.501 ' HB2' ' HB2' ' B' ' 78' ' ' ASP . 2.3 mm? -54.75 -19.59 6.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.701 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.41 -25.22 13.35 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 8.2 mmm -98.87 -2.04 38.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -178.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.42 88.02 2.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.03 -156.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.053 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . 0.427 ' N ' ' CD1' ' B' ' 86' ' ' LEU . 5.9 mp 63.28 29.54 15.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.904 0.383 . . . . 0.0 110.972 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.25 -42.48 1.51 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.732 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 17.4 t70 -70.65 -9.46 57.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.052 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.445 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 2.6 mp -88.67 -55.98 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.35 -20.04 65.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.338 177.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.93 -63.72 1.27 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.614 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 1.2 tt -51.52 -24.38 5.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.918 0.389 . . . . 0.0 110.433 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 93' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 3.9 mm? -90.21 -40.96 11.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.403 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.84 -13.53 59.71 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.223 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.32 -50.2 0.31 Allowed Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.457 -0.878 . . . . 0.0 113.182 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -98.18 -2.62 39.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.95 33.1 0.13 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.788 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 18.6 t . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.227 -179.757 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.3 p . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.72 0.295 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -170.33 -41.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.231 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -149.6 131.68 15.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 0.0 111.313 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.75 -31.29 6.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.817 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.502 ' O ' ' C ' ' A' ' 55' ' ' THR . 9.0 mt 64.47 -80.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.239 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.502 ' C ' ' O ' ' A' ' 54' ' ' LEU . 97.2 m 6.54 -90.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.46 -70.05 0.12 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.438 ' HA ' ' HB2' ' A' ' 60' ' ' ARG . 4.6 t -50.18 -25.08 2.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.577 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.722 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.39 73.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.62 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.585 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 20.0 m -69.49 -15.72 63.31 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.438 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -73.38 -74.03 0.19 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.475 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.712 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.4 mm? -62.06 -28.29 69.49 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 119.362 -0.935 . . . . 0.0 109.992 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.462 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 2.6 tt0 -65.08 -39.04 92.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.2 ttm105 -66.73 -28.18 68.21 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.414 ' CD1' ' CD2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -72.77 -27.42 61.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.748 178.533 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.442 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 0.1 OUTLIER -78.01 -32.96 51.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.015 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.75 -22.93 45.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.6 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -77.56 -29.52 52.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.884 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.466 ' O ' ' CB ' ' A' ' 69' ' ' LEU . 0.1 OUTLIER 72.34 -165.57 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.778 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.466 ' CB ' ' O ' ' A' ' 68' ' ' PHE . 8.0 tp 86.88 -33.05 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.85 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.414 ' CD2' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -113.68 -16.39 12.33 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.474 0.178 . . . . 0.0 111.225 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.421 HD11 ' CE1' ' A' ' 68' ' ' PHE . 60.8 mt -51.64 -37.18 19.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.714 0.293 . . . . 0.0 111.271 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.43 ' CG ' ' HD2' ' A' ' 73' ' ' PRO . 1.4 t80 -109.03 142.24 25.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.815 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.43 ' HD2' ' CG ' ' A' ' 72' ' ' PHE . 51.2 Cg_endo -69.15 -28.8 27.74 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.458 2.106 . . . . 0.0 112.291 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -112.13 -179.48 3.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.739 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -98.06 -49.29 4.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.056 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.07 146.47 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.023 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -103.13 -80.05 0.52 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.738 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 71.85 -57.58 0.61 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.298 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.39 6.16 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.684 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 58.0 mt -61.16 -29.97 46.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 111.144 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.4 mt -73.2 -26.7 61.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.049 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.8 -19.63 22.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.5 mtm -93.01 -22.88 18.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.039 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -86.8 -60.72 1.91 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.65 120.41 0.91 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.882 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -169.76 -41.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.018 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -74.08 -38.74 63.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.029 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.496 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 5.1 m-20 -70.36 -11.41 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.465 ' N ' ' CD1' ' A' ' 89' ' ' ILE . 2.1 mp -91.55 -54.95 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.24 -19.63 64.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.33 4.26 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.158 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 3.3 mm? -53.08 -26.18 15.33 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.081 0.467 . . . . 0.0 109.841 178.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.441 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 0.5 OUTLIER -92.55 -38.05 12.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.165 179.206 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.5 m -63.3 -15.05 56.08 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.012 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.7 -28.85 1.11 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.41 -0.9 . . . . 0.0 113.395 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.412 ' CB ' ' O ' ' A' ' 92' ' ' LEU . 0.5 OUTLIER -104.31 5.41 34.54 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 21.9 p90 -36.69 139.56 0.18 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.688 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 28.0 t -71.0 117.39 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.082 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -74.92 -31.05 61.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.971 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.77 163.1 15.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -115.63 -41.69 3.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.98 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.1 p 43.9 44.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.653 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.9 p30 42.92 92.18 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.431 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.5 mttm -108.9 -15.77 14.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.25 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -96.58 33.4 1.83 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.926 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.16 179.956 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.821 0.343 . . . . 0.0 111.246 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -123.23 -78.53 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.891 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.58 131.73 13.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.319 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.64 -31.29 6.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.858 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.499 ' O ' ' C ' ' B' ' 55' ' ' THR . 9.0 mt 64.32 -80.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.215 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.499 ' C ' ' O ' ' B' ' 54' ' ' LEU . 97.6 m 6.39 -90.47 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -70.17 0.11 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.948 0.404 . . . . 0.0 112.083 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.444 ' HA ' ' HB2' ' B' ' 60' ' ' ARG . 4.6 t -50.15 -25.0 2.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.562 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.712 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.43 73.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.612 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.581 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 19.9 m -69.45 -15.68 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.444 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.3 OUTLIER -73.46 -74.0 0.19 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.505 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.4 mm? -62.02 -28.34 69.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.841 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.462 ' CB ' ' O ' ' B' ' 58' ' ' GLU . 2.6 tt0 -65.15 -38.97 92.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.1 ttm105 -66.82 -28.03 68.03 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.417 ' CD1' ' CD2' ' B' ' 70' ' ' LEU . 0.1 OUTLIER -72.96 -27.49 61.85 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.567 178.644 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.442 ' HB2' ' HB2' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -77.96 -33.02 51.73 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.027 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.67 -23.01 45.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.596 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -77.47 -29.48 52.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.987 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . 0.452 ' O ' ' CB ' ' B' ' 69' ' ' LEU . 0.1 OUTLIER 72.24 -165.46 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.826 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' B' ' 68' ' ' PHE . 0.3 OUTLIER 86.58 -33.01 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.891 179.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.417 ' CD2' ' CD1' ' B' ' 64' ' ' LEU . 0.1 OUTLIER -113.49 -16.37 12.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.525 0.203 . . . . 0.0 111.254 -179.779 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . 0.417 HD11 ' CE1' ' B' ' 68' ' ' PHE . 60.9 mt -51.66 -37.1 19.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.767 0.318 . . . . 0.0 111.354 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . 0.432 ' CG ' ' HD2' ' B' ' 73' ' ' PRO . 1.4 t80 -109.04 142.1 24.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.774 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' B' ' 72' ' ' PHE . 51.3 Cg_endo -69.14 -28.75 27.84 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.447 2.098 . . . . 0.0 112.361 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -111.84 179.77 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.875 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -93.45 -60.33 1.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.988 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.49 155.72 26.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.856 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.429 HD22 ' CZ ' ' B' ' 72' ' ' PHE . 1.9 mt -109.21 -79.04 0.59 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.785 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 72.85 -57.87 0.62 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.399 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.44 6.12 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.768 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.421 HD12 HG22 ' B' ' 80' ' ' ILE . 58.1 mt -61.1 -30.08 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.057 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 1.4 mt -73.11 -26.82 61.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.065 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.68 -19.65 22.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.212 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 9.6 mtm -93.05 -22.84 18.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 0.0 111.053 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -86.79 -60.76 1.9 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.901 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.68 120.53 0.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.98 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -169.78 -42.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -73.71 -38.72 64.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.982 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . 0.48 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 5.1 m-20 -70.38 -11.47 60.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.34 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.465 ' CD1' ' N ' ' B' ' 89' ' ' ILE . 2.1 mp -91.52 -55.09 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.21 -19.55 64.62 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.136 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.28 4.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.255 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 3.3 mm? -53.12 -26.1 15.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.047 0.451 . . . . 0.0 109.833 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.443 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -92.56 -38.12 12.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.087 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -63.21 -15.23 56.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.98 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.55 -28.96 1.12 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.412 -0.899 . . . . 0.0 113.37 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.413 ' CB ' ' O ' ' B' ' 92' ' ' LEU . 0.5 OUTLIER -104.23 5.33 34.7 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.327 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.443 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 21.5 p90 -36.73 139.51 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.68 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 27.2 t -70.94 117.51 14.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.103 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -74.99 -31.05 61.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.96 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.79 163.1 15.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.861 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -115.56 -41.71 3.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.023 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.4 p 43.75 44.8 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.658 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 6.9 p30 42.97 92.09 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.521 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -108.84 -15.89 14.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.174 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -96.25 33.17 1.8 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.79 0.329 . . . . 0.0 111.015 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.174 -179.974 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.805 0.336 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.38 139.35 35.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.417 ' HB3' ' CE1' ' B' ' 53' ' ' HIS . . . -176.84 -162.61 0.08 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.049 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.434 ' CE1' ' HB3' ' B' ' 52' ' ' ALA . 90.0 m-70 65.23 153.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.438 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.514 ' HA ' ' HB3' ' A' ' 58' ' ' GLU . 4.6 mp 64.26 -137.52 0.29 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.705 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.42 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.7 m 27.94 -84.94 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 54' ' ' LEU . 4.1 mm-40 -66.41 -64.43 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.138 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.41 ' HB ' ' CG1' ' B' ' 57' ' ' VAL . 20.6 t -56.84 -44.11 81.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.193 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.68 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 4.7 pt-20 -55.4 -48.68 73.99 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-O 121.451 0.643 . . . . 0.0 109.514 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.436 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 1.2 m -64.38 -19.06 65.25 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.654 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.04 -73.85 0.19 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.228 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.5 mm? -62.97 -25.36 68.33 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.09 -179.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.45 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 2.5 tt0 -69.33 -38.3 78.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.38 -30.36 71.17 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 177.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.451 178.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -32.15 64.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.163 178.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.96 -23.12 44.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.843 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.99 -22.84 33.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 63.76 175.65 0.17 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.967 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tp -129.71 -66.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.973 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.5 mt -124.6 47.25 2.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.18 -58.05 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.086 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -113.73 101.72 54.08 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.82 -51.2 1.36 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.391 2.06 . . . . 0.0 112.348 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.57 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.804 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -175.99 118.22 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.002 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -159.08 -63.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 74.59 5.66 4.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -130.94 -34.04 1.51 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.659 0.266 . . . . 0.0 111.354 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -28.02 61.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.333 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.67 -65.03 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.005 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.67 -18.75 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.07 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -80.72 -31.83 35.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 mtm -89.1 -18.2 27.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.98 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -94.25 -40.29 10.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.91 0.386 . . . . 0.0 110.847 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.03 139.07 30.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.45 18.16 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.112 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.78 23.25 11.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.128 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.83 -11.29 60.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.896 0.379 . . . . 0.0 110.936 179.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.463 ' N ' ' CD1' ' A' ' 89' ' ' ILE . 2.4 mp -93.31 -50.93 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.83 -21.58 66.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.459 -0.791 . . . . 0.0 108.931 177.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.02 -48.97 7.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.195 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.86 -25.27 56.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.202 0.525 . . . . 0.0 109.778 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.12 -36.68 11.96 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.225 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.0 m -65.82 -15.41 62.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.933 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.37 -36.36 0.65 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.218 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.94 -2.28 40.93 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.4 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 18.2 p90 38.78 75.84 0.07 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.806 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 42.1 t -72.0 141.12 17.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.935 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -154.23 108.08 2.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.894 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -176.98 166.73 2.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.922 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.41 151.54 19.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.89 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.0 m -148.42 -45.57 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.245 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 64.85 -175.75 0.17 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.875 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -126.16 152.74 45.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.918 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.28 113.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.936 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.312 -0.852 . . . . 0.0 111.158 179.932 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 13.4 m . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.814 0.34 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 14.7 mtt85 -157.61 36.96 0.27 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.801 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . 0.434 ' HB3' ' CE1' ' A' ' 53' ' ' HIS . . . -176.73 -162.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.181 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . 0.417 ' CE1' ' HB3' ' A' ' 52' ' ' ALA . 89.8 m-70 65.38 153.66 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.027 0.442 . . . . 0.0 111.238 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.504 ' HA ' ' HB3' ' B' ' 58' ' ' GLU . 4.5 mp 64.13 -137.5 0.3 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.768 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.42 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.4 m 27.88 -84.83 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' B' ' 54' ' ' LEU . 4.1 mm-40 -66.45 -64.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.794 0.331 . . . . 0.0 111.192 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.41 ' CG1' ' HB ' ' A' ' 57' ' ' VAL . 20.6 t -56.86 -44.12 81.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.119 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.675 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 4.7 pt-20 -55.54 -48.49 74.64 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.336 0.589 . . . . 0.0 109.477 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 1.2 m -64.5 -19.06 65.36 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.24 -73.66 0.2 Allowed 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.203 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.5 mm? -63.14 -25.16 68.22 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.126 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' B' ' 58' ' ' GLU . 2.4 tt0 -69.52 -38.2 77.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 176.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -30.42 71.22 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.395 178.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.5 -32.21 64.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.129 179.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -23.2 44.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.834 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -22.86 33.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.145 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 63.81 175.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.911 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 mp -129.59 -67.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 42.7 mt -124.01 47.36 2.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.104 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.27 -58.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -113.66 101.79 54.12 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.85 -51.19 1.35 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.325 2.017 . . . . 0.0 112.462 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.66 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.114 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -152.1 -174.64 4.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.924 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 68.93 114.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.069 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.0 mp -101.64 47.62 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.645 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -127.25 -34.03 2.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.18 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -28.06 62.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.195 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.61 -65.05 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.988 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -18.8 63.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.04 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -80.7 -31.88 36.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 0.0 110.742 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 1.2 mtm -88.98 -18.34 27.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.93 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -94.28 -40.18 10.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.774 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.12 139.03 30.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.882 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.6 tp -94.51 18.16 11.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.91 23.2 11.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.128 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.92 -11.25 60.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 0.0 110.893 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.459 ' CD1' ' N ' ' B' ' 89' ' ' ILE . 2.4 mp -93.11 -51.06 11.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.02 -21.34 66.83 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.809 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.07 -49.03 7.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.211 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.85 -25.27 56.03 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.104 0.478 . . . . 0.0 109.726 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.05 -36.76 11.97 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.154 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.9 m -65.87 -15.45 62.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.814 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.33 -36.46 0.65 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.27 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.96 -2.33 40.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.997 0.399 . . . . 0.0 112.049 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.403 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 18.0 p90 38.8 75.79 0.07 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.749 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 41.9 t -71.95 141.02 17.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.043 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -154.07 108.07 3.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.964 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -177.12 166.65 2.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.822 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.32 151.66 19.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.852 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.0 m -148.49 -45.71 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.182 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 64.9 -175.7 0.17 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.815 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.23 152.75 45.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.958 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.35 113.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.917 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.171 179.969 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.9 t . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.717 0.294 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -94.42 -47.64 6.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.027 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 67.42 131.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.3 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 51.63 -97.74 0.06 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.929 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 58' ' ' GLU . 0.4 OUTLIER 66.14 -73.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.601 0.238 . . . . 0.0 111.335 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.448 ' C ' ' O ' ' A' ' 54' ' ' LEU . 55.7 m 9.34 -76.54 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.6 pt-20 -63.27 -60.56 3.24 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.606 ' CG1' ' HB ' ' B' ' 57' ' ' VAL . 17.2 t -59.12 -48.58 86.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.651 -179.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.704 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.02 -46.41 68.4 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 121.292 0.568 . . . . 0.0 109.555 179.035 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.7 -21.42 66.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.544 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.432 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.3 -71.59 0.25 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.381 -179.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -62.1 -30.68 71.18 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.812 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.438 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 45.7 tt0 -63.29 -37.56 87.73 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.89 -29.93 69.15 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.8 -27.78 64.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 121.484 0.659 . . . . 0.0 109.516 178.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -78.56 -31.77 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.502 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.67 -33.43 66.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.764 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.462 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 3.9 mp -63.08 -26.05 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.462 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 3.2 m-85 68.71 -61.0 0.43 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.442 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 70.71 -65.38 0.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.768 0.318 . . . . 0.0 110.667 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 30.9 mt -137.41 53.9 1.85 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.606 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.431 ' HB ' ' CD2' ' A' ' 68' ' ' PHE . 36.1 mm -127.14 -45.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.187 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.431 ' CD2' ' O ' ' A' ' 72' ' ' PHE . 37.6 p90 -48.0 105.5 0.5 Allowed Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.213 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -79.15 132.65 10.49 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.136 . . . . 0.0 112.289 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.0 -46.86 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.61 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -165.67 65.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.043 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.56 -81.16 0.36 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.7 mt -96.93 112.09 24.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.647 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.475 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 4.0 t0 -178.94 89.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.98 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.457 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 13.6 ptt? -53.09 -45.26 68.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.684 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.444 ' HB ' ' CD2' ' B' ' 81' ' ' LEU . 45.1 mm -65.07 -49.57 78.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.775 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.475 ' HB2' ' HB3' ' A' ' 78' ' ' ASP . 1.2 mm? -64.84 -21.29 66.76 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.457 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 9.0 pttp -93.54 -24.71 17.87 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.434 ' HG2' ' HA ' ' A' ' 80' ' ' ILE . 18.5 ptp -93.91 -15.26 25.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.82 -65.37 0.31 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.75 0.309 . . . . 0.0 110.935 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.9 m 65.04 65.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 mp -150.15 32.67 0.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.703 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -112.99 -35.91 5.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.994 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -71.75 -13.47 61.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 111.031 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.444 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 26.2 mm -86.16 -57.37 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.513 ' O ' ' HB ' ' A' ' 94' ' ' THR . 30.2 tt0 -64.13 -18.84 64.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.303 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.41 ' O ' HG21 ' A' ' 94' ' ' THR . . . -83.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.525 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 96' ' ' LEU . 6.5 mp -49.31 -29.22 5.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.024 0.44 . . . . 0.0 110.448 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 4.3 mm? -85.24 -38.97 18.31 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.5 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.513 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 8.7 t -73.16 -7.59 52.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.957 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -113.05 -32.53 2.19 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 2.8 mm? -98.31 -7.42 29.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.975 0.388 . . . . 0.0 111.843 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 44.8 p90 31.92 42.03 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.887 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.4 p -81.42 158.24 4.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.284 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -112.13 81.45 1.47 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.85 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.88 175.73 2.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.895 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -111.32 140.48 45.86 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.956 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 m -148.6 166.66 4.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.141 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -111.98 167.17 10.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.939 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.4 -57.76 2.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.813 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -63.43 -49.08 75.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.913 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.18 179.912 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 81.8 p . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.795 0.331 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 62.3 -165.44 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.759 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . 68.09 131.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.854 0.359 . . . . 0.0 111.055 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . 0.4 ' O ' ' N ' ' B' ' 55' ' ' THR . 5.5 t-80 51.79 -97.75 0.06 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.896 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.551 ' HB3' ' HG2' ' B' ' 58' ' ' GLU . 0.4 OUTLIER 66.18 -73.94 0.07 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.664 0.268 . . . . 0.0 111.317 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.453 ' C ' ' O ' ' B' ' 54' ' ' LEU . 57.3 m 9.45 -76.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.6 pt-20 -63.31 -60.47 3.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.606 ' HB ' ' CG1' ' A' ' 57' ' ' VAL . 17.1 t -59.05 -48.63 86.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 122.157 -0.339 . . . . 0.0 111.665 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.722 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.08 -46.37 68.58 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.345 0.593 . . . . 0.0 109.583 179.11 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.66 -21.52 66.75 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.536 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.424 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.15 -71.83 0.24 Allowed 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.285 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -62.04 -30.77 71.2 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 119.467 -0.893 . . . . 0.0 109.798 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.44 ' HB2' ' CD1' ' A' ' 61' ' ' LEU . 45.6 tt0 -63.14 -37.53 87.6 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.79 -29.97 69.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.258 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -27.81 64.14 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.498 178.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -78.59 -31.75 47.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.553 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.65 -33.34 66.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.861 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.456 ' O ' ' HB2' ' B' ' 68' ' ' PHE . 3.9 mp -63.11 -26.2 68.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.378 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . 0.492 ' O ' ' HB2' ' B' ' 69' ' ' LEU . 3.2 m-85 68.77 -60.52 0.44 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.631 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.492 ' HB2' ' O ' ' B' ' 68' ' ' PHE . 2.0 mt 69.51 -64.58 0.34 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.818 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 30.7 mt -137.57 53.86 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.973 0.416 . . . . 0.0 110.666 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . 0.427 ' HB ' ' CD2' ' B' ' 68' ' ' PHE . 36.8 mm -127.21 -44.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.173 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . 0.43 ' O ' ' CD2' ' B' ' 72' ' ' PHE . 37.7 p90 -47.96 105.42 0.49 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.212 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -79.11 132.69 10.56 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.532 2.154 . . . . 0.0 112.24 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.2 -50.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.12 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.34 31.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.88 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -141.79 136.9 31.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.856 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 mt 65.47 83.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.047 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . 0.457 ' HB3' ' HB2' ' B' ' 81' ' ' LEU . 4.0 t0 -173.36 88.37 0.07 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.856 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.478 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 13.7 ptt? -53.02 -45.2 67.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.639 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.448 ' HA ' ' HG2' ' B' ' 83' ' ' MET . 45.0 mm -65.22 -49.49 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.686 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.457 ' HB2' ' HB3' ' B' ' 78' ' ' ASP . 1.2 mm? -64.96 -21.22 66.8 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . 0.478 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 8.9 pttp -93.64 -24.66 17.81 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' MET . . . . . 0.448 ' HG2' ' HA ' ' B' ' 80' ' ' ILE . 18.4 ptp -93.87 -15.22 25.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.621 0.248 . . . . 0.0 111.651 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.74 -65.33 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.726 0.298 . . . . 0.0 110.975 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 43.0 m 65.13 64.89 0.6 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 mp -149.43 32.74 0.72 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.738 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -113.15 -36.05 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.199 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -71.72 -13.45 61.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 111.047 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.443 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 26.0 mm -86.15 -57.43 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.511 ' O ' ' HB ' ' B' ' 94' ' ' THR . 30.1 tt0 -63.9 -19.08 64.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.354 178.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . 0.401 ' O ' HG21 ' B' ' 94' ' ' THR . . . -83.84 -67.55 0.78 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.653 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' B' ' 96' ' ' LEU . 6.5 mp -49.31 -29.37 5.93 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.961 0.41 . . . . 0.0 110.37 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 4.3 mm? -85.14 -38.93 18.47 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.56 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 8.8 t -73.15 -7.7 52.55 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.983 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -112.92 -32.49 2.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.857 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 2.8 mm? -98.39 -7.39 28.83 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 117.023 0.411 . . . . 0.0 111.753 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 44.5 p90 31.82 42.11 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.843 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.4 p -81.39 158.26 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.396 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -112.16 81.54 1.48 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.85 175.7 2.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.9 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -111.3 140.38 45.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.949 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 m -148.54 166.71 4.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.218 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -112.02 166.99 10.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.837 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.29 -57.69 2.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.893 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -63.37 -49.09 75.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.935 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.093 179.964 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.824 0.345 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 30.1 mtt-85 -141.29 154.65 45.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.86 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -172.8 126.9 0.48 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.088 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.6 p-80 -106.72 86.94 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.036 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.402 ' O ' ' CG ' ' A' ' 58' ' ' GLU . 11.1 mp -128.41 8.93 6.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.301 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.461 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.2 OUTLIER -52.8 -56.29 16.79 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.612 -179.796 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.66 -42.64 64.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.247 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 2.5 t -62.99 -38.71 82.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 CA-C-O 120.868 0.366 . . . . 0.0 111.114 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.659 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -61.22 -52.05 66.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.851 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 t -61.28 -20.22 62.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.291 177.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.419 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 11.4 tpp180 -69.66 -73.59 0.15 Allowed 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.346 -179.14 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.64 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.2 mm? -62.63 -30.16 71.15 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.024 -1.071 . . . . 0.0 110.025 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.41 ' HB2' HD11 ' B' ' 61' ' ' LEU . 65.4 tt0 -62.5 -36.67 83.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.314 177.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.86 -15.28 48.77 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.431 ' CD1' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -86.27 -21.48 27.34 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.239 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.512 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 2.4 mm-40 -112.47 -18.32 12.46 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.331 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.29 89.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.405 ' N ' ' O ' ' A' ' 65' ' ' GLU . 7.0 mt 62.78 17.1 9.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.38 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.4 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 1.4 t80 -103.51 98.4 8.3 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.728 0.299 . . . . 0.0 111.026 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tt -177.19 -72.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.024 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.27 -39.02 0.15 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.915 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 16.6 mm -48.72 -26.99 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.566 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.73 77.19 0.39 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.847 0.356 . . . . 0.0 111.0 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.26 -46.66 1.34 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.575 2.183 . . . . 0.0 112.3 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.56 74.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.003 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 67.84 -69.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.058 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -70.66 138.67 50.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 pp -100.55 131.4 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.912 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.89 -38.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.954 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.06 -23.18 31.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.096 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.9 mp -62.6 -50.76 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.335 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.37 -11.13 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.475 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -88.55 -22.92 23.32 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.67 0.271 . . . . 0.0 111.191 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.5 mtm -116.1 -43.54 2.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.353 . . . . 0.0 111.002 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.53 89.69 3.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.869 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 87.6 p -158.35 154.81 27.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.08 13.69 18.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.261 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.84 17.21 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.246 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 0.3 OUTLIER -73.35 -14.61 61.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.07 179.779 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.408 ' CG2' ' HB ' ' B' ' 89' ' ' ILE . 10.6 mm -92.99 -50.37 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -63.4 -21.86 66.54 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.93 -52.0 5.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.1 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 2.3 mm? -52.33 -27.34 14.99 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.182 0.515 . . . . 0.0 109.619 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.426 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 0.2 OUTLIER -91.01 -36.93 13.78 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.04 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.21 -13.62 50.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.872 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.71 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.214 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.22 3.63 41.11 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 21.2 p90 -41.84 133.22 2.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.596 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.0 p 51.67 168.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.992 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.5 123.94 3.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.703 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.33 147.9 45.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.064 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 59.41 160.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.048 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.5 t 61.45 153.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.14 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -131.0 -178.05 4.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.55 144.45 35.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.87 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.02 163.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.948 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.073 179.967 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 7.2 m . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.801 0.334 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.67 -57.72 2.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.776 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -172.62 126.87 0.5 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.028 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 18.3 p-80 -106.83 87.04 2.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.942 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 11.0 mp -128.38 8.91 6.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.418 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.465 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -52.77 -56.33 16.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 111.523 -179.787 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.77 -42.59 65.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.227 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.425 ' O ' ' HB3' ' B' ' 60' ' ' ARG . 2.4 t -62.82 -38.76 82.64 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-O 120.926 0.393 . . . . 0.0 111.172 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.64 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -61.26 -52.08 66.24 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 7.7 t -61.29 -20.26 62.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.381 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.425 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 11.5 tpp180 -69.69 -73.58 0.16 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.297 -179.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.659 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.2 mm? -62.45 -30.45 71.25 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.081 -1.048 . . . . 0.0 110.018 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -62.45 -36.49 82.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.372 177.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.94 -15.3 48.4 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.634 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.434 ' CD1' HD12 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -86.32 -21.5 27.24 Favored 'General case' 0 CA--C 1.523 -0.093 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.289 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.512 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 2.4 mm-40 -112.38 -18.43 12.47 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.384 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.23 89.19 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.952 0.406 . . . . 0.0 111.007 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.403 ' N ' ' O ' ' B' ' 65' ' ' GLU . 7.0 mt 62.92 16.87 9.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.359 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -103.32 98.34 8.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.758 0.314 . . . . 0.0 110.994 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tp -176.93 -73.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.998 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 -39.02 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.981 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 16.5 mm -48.57 -27.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.637 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.78 77.22 0.39 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.972 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.1 -46.59 1.43 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.525 2.15 . . . . 0.0 112.429 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.57 74.0 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 67.8 -67.83 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.145 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.28 138.17 49.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.979 0.418 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.17 129.98 46.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.828 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.55 -38.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.936 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.07 -23.2 32.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.172 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.9 mp -62.36 -50.95 77.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.376 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.4 -11.0 47.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.55 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -88.66 -22.77 23.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.739 0.304 . . . . 0.0 111.265 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.6 mtm -116.26 -43.52 2.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.91 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.57 89.74 3.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 86.5 p -158.4 154.8 27.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.833 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 mt -92.06 13.67 18.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.93 17.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.272 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 0.3 OUTLIER -73.36 -14.54 61.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.102 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.408 ' HB ' ' CG2' ' A' ' 89' ' ' ILE . 10.6 mm -93.05 -50.34 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -63.39 -21.82 66.52 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.04 -51.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.994 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 2.3 mm? -52.35 -27.32 15.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.282 0.563 . . . . 0.0 109.597 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 0.2 OUTLIER -91.08 -36.84 13.78 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.078 178.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.18 -13.71 50.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.916 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.7 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.195 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.19 3.72 41.28 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 21.4 p90 -41.82 133.16 2.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.698 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 3.0 p 51.71 168.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.048 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.39 123.94 3.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.759 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.31 147.87 45.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.085 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 59.46 160.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.047 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 21.4 t 61.47 153.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.121 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -131.05 -178.13 4.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -140.53 144.38 35.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.911 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.98 163.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.9 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.164 -179.889 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.771 0.319 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 -170.33 2.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.797 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.07 -22.78 66.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.255 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 63.6 -80.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.977 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.418 ' O ' ' C ' ' A' ' 55' ' ' THR . 0.8 OUTLIER -94.78 -68.12 0.82 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.827 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.9 m 22.23 -86.17 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.8 mt-10 -60.06 -68.34 0.3 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.87 0.367 . . . . 0.0 111.495 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.517 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 41.4 t -56.77 -21.78 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.672 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.674 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.9 pt-20 -70.31 -45.95 65.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.413 ' N ' ' HG2' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -68.52 -17.15 64.1 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.241 -0.89 . . . . 0.0 108.961 177.136 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.517 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 0.4 OUTLIER -73.76 -75.23 0.16 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.529 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.3 mm? -60.62 -29.11 69.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.072 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.472 ' CB ' ' O ' ' A' ' 58' ' ' GLU . 3.5 tt0 -66.35 -38.2 87.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -66.83 -27.69 67.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -27.31 58.96 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.601 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.427 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 8.4 tm-20 -78.29 -30.06 48.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.403 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.42 -31.14 69.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.712 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.49 -10.77 45.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.226 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 63.41 143.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.787 0.327 . . . . 0.0 110.983 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 mt -93.84 -63.49 1.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.845 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 31.5 mt -147.0 33.53 0.91 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.482 HD11 HG22 ' A' ' 71' ' ' ILE . 23.6 mm -89.74 -58.81 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.218 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.3 112.24 46.7 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.975 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.51 -160.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.52 2.147 . . . . 0.0 112.285 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -134.56 162.1 33.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.348 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 56.52 -157.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.669 0.271 . . . . 0.0 110.927 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -78.41 -38.07 42.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.523 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.5 mt -46.94 114.47 0.85 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.076 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.476 ' HB3' ' HG ' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -130.72 106.28 8.36 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.13 0.49 . . . . 0.0 112.001 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.429 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -68.88 -39.2 79.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.615 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.91 -46.84 95.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.879 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.476 ' HG ' ' HB3' ' A' ' 78' ' ' ASP . 0.2 OUTLIER -78.95 -25.75 43.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.923 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -84.59 -18.39 35.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.329 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 32.3 mtm -107.92 -23.29 12.1 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.411 ' CB ' HD11 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -58.19 -75.0 0.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.8 0.334 . . . . 0.0 111.304 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -174.27 127.65 0.35 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.116 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -158.43 29.34 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.585 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -97.42 -15.34 20.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.266 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -70.6 -12.09 61.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.913 0.387 . . . . 0.0 111.163 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.443 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 11.2 mm -86.92 -57.51 4.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.523 ' O ' ' HB ' ' A' ' 94' ' ' THR . 40.0 tt0 -63.28 -19.21 64.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.179 177.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.426 ' O ' HG21 ' A' ' 94' ' ' THR . . . -83.27 -68.64 0.69 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.258 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.415 ' O ' ' HB2' ' A' ' 96' ' ' LEU . 1.3 tt -47.52 -28.27 2.16 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.118 0.485 . . . . 0.0 110.263 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 0.3 OUTLIER -83.25 -40.47 19.55 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.644 179.125 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 4.0 t -69.22 -9.53 53.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.889 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.94 -33.57 3.0 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.197 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.7 OUTLIER -87.77 -8.04 56.52 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 120.974 0.416 . . . . 0.0 111.058 179.282 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.425 ' CE1' ' HB ' ' B' ' 98' ' ' VAL . 0.3 OUTLIER 65.98 -152.66 0.24 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.297 -179.466 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.423 ' HB ' ' CE1' ' B' ' 97' ' ' PHE . 21.8 t -145.19 117.06 2.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.754 0.312 . . . . 0.0 111.114 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -148.07 135.9 20.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.843 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 43.68 92.52 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.453 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -138.15 102.28 4.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.927 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 31.5 m -125.92 -44.87 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.047 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -153.68 -46.49 0.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.959 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp 63.83 129.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.858 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.19 94.02 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.966 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.189 179.961 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.401 ' HB ' ' CE1' ' B' ' 53' ' ' HIS . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.803 0.335 . . . . 0.0 111.088 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 7.0 mmt-85 -63.34 177.11 0.69 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.995 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.47 -22.6 65.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.136 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . 0.401 ' CE1' ' HB ' ' B' ' 50' ' ' THR . 14.4 m-70 63.58 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.419 ' O ' ' C ' ' B' ' 55' ' ' THR . 0.8 OUTLIER -94.74 -68.05 0.82 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.864 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.554 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 97.7 m 22.16 -86.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.8 mt-10 -60.0 -68.3 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 0.0 111.452 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.518 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 41.7 t -56.84 -21.74 14.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.658 -179.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.674 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.9 pt-20 -70.32 -46.0 65.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.406 ' N ' ' HG2' ' B' ' 58' ' ' GLU . 0.3 OUTLIER -68.39 -17.3 64.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.006 177.138 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.518 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 0.4 OUTLIER -73.74 -75.2 0.16 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.553 -179.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.674 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.3 mm? -60.38 -29.38 68.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.144 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.473 ' CB ' ' O ' ' B' ' 58' ' ' GLU . 3.6 tt0 -66.35 -38.09 86.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' B' ' 59' ' ' SER . 6.2 ttt85 -66.88 -27.76 67.77 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -27.29 59.1 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.544 0.687 . . . . 0.0 109.626 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.427 ' HB2' ' HB2' ' A' ' 65' ' ' GLU . 8.5 tm-20 -78.25 -30.12 48.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.382 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 -31.15 69.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.669 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.42 -10.8 45.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.353 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 63.56 143.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.814 0.34 . . . . 0.0 110.949 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.0 tp -93.49 -63.62 1.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.984 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 30.6 mt -146.83 33.55 0.93 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.855 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . 0.471 HG22 HD11 ' B' ' 71' ' ' ILE . 23.4 mm -89.71 -58.87 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.166 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.24 112.22 46.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.952 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.43 -160.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.527 2.151 . . . . 0.0 112.313 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -134.22 164.0 28.36 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -52.65 96.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.168 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 179.06 -38.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.259 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.9 tp 179.66 148.53 0.27 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.426 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . 0.456 ' HB3' ' HG ' ' B' ' 81' ' ' LEU . 0.6 OUTLIER -116.97 104.68 11.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.077 0.465 . . . . 0.0 110.808 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.429 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 0.0 OUTLIER -68.42 -39.06 81.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.621 -179.429 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -62.03 -46.78 95.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.456 ' HG ' ' HB3' ' B' ' 78' ' ' ASP . 0.2 OUTLIER -79.06 -25.54 43.13 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.0 -178.955 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 0.0 OUTLIER -84.84 -18.43 34.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.354 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 32.6 mtm -107.84 -23.18 12.16 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.39 -74.83 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.727 0.299 . . . . 0.0 111.257 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -174.43 127.71 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.194 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -158.41 28.93 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.613 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -96.89 -15.45 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.284 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -70.73 -12.01 61.3 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.077 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.428 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 11.2 mm -86.76 -57.65 4.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.533 ' O ' ' HB ' ' B' ' 94' ' ' THR . 40.0 tt0 -63.31 -19.19 64.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.187 177.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . 0.424 ' O ' HG21 ' B' ' 94' ' ' THR . . . -83.23 -68.63 0.69 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.345 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' B' ' 96' ' ' LEU . 1.3 tt -47.56 -28.33 2.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.959 0.409 . . . . 0.0 110.128 179.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER -83.18 -40.5 19.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.679 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.533 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 4.0 t -69.1 -9.67 53.84 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.841 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.98 -33.54 3.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.128 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 0.7 OUTLIER -87.83 -8.02 56.46 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.008 0.432 . . . . 0.0 111.104 179.286 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.423 ' CE1' ' HB ' ' A' ' 98' ' ' VAL . 0.4 OUTLIER 66.01 -152.74 0.24 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.214 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . 0.425 ' HB ' ' CE1' ' A' ' 97' ' ' PHE . 21.9 t -145.12 117.02 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 111.15 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -148.02 135.9 21.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.873 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 43.67 92.49 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.411 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -138.12 102.44 4.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.947 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 31.3 m -125.92 -44.91 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.048 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -153.7 -46.47 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.937 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 63.72 129.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.914 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.37 94.06 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.898 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.257 -0.877 . . . . 0.0 111.162 -179.988 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.834 0.35 . . . . 0.0 111.142 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.75 -49.57 2.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.956 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.55 -60.31 2.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.057 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 64.99 74.39 0.39 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.143 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.468 ' HA ' ' CG1' ' B' ' 57' ' ' VAL . 1.5 mt -147.14 -96.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.522 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 0.2 OUTLIER 37.82 -142.73 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.099 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.71 -64.17 0.19 Allowed 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.465 ' CG1' ' HA ' ' B' ' 54' ' ' LEU . 34.0 t -50.45 -37.21 14.59 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.636 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.3 pt-20 -61.36 -48.09 82.9 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -66.27 -15.64 63.37 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.381 177.802 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.422 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 29.2 ttm-85 -72.96 -71.35 0.31 Allowed 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.554 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -64.58 -27.29 68.85 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.851 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.447 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 1.9 tt0 -68.58 -33.44 74.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.57 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.0 OUTLIER -81.4 -19.37 42.73 Favored 'General case' 0 C--O 1.231 0.102 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.452 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.407 HD22 ' N ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -82.98 -24.01 33.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.253 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' B' ' 65' ' ' GLU . 0.6 OUTLIER -93.93 -65.14 1.01 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.655 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.449 ' O ' ' CB ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.33 133.89 53.55 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.449 ' CB ' ' O ' ' A' ' 66' ' ' GLN . 0.5 OUTLIER 83.4 -45.73 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.777 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.65 88.7 3.29 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.969 0.414 . . . . 0.0 110.669 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.07 161.2 38.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.738 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.63 -19.49 58.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.273 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 15.7 mm -125.05 27.51 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.643 0.259 . . . . 0.0 111.633 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.417 ' CE2' ' HB2' ' A' ' 74' ' ' ARG . 5.1 p90 -58.04 137.29 84.03 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.006 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.468 2.112 . . . . 0.0 112.335 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.417 ' HB2' ' CE2' ' A' ' 72' ' ' PHE . 0.0 OUTLIER -169.06 -65.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -70.94 0.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 61.39 154.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.78 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 pp -150.11 26.64 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.136 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 62.56 69.52 0.6 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.935 0.397 . . . . 0.0 110.893 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 29.0 mtp -65.27 -49.16 70.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.692 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.0 mp -76.6 -41.19 34.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.15 -30.15 69.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.661 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.45 -29.75 18.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.392 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.81 -24.24 63.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.769 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.6 96.63 10.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.5 m -54.06 109.92 0.54 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.179 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 pp -139.39 26.39 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.56 -21.88 13.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -7.01 49.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 0.0 111.105 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.458 ' N ' ' CD1' ' A' ' 89' ' ' ILE . 2.6 mp -91.79 -54.05 7.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.63 -20.88 66.09 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.2 178.014 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -56.83 3.16 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.265 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.415 ' CB ' ' O ' ' A' ' 88' ' ' ASP . 32.8 tp -54.76 -24.09 20.91 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.2 mt -92.24 -39.53 11.48 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.544 179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.65 -13.85 61.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.146 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.11 -40.89 0.46 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.422 -0.894 . . . . 0.0 113.345 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.71 -0.44 16.0 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 30.4 p90 39.53 53.4 2.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.603 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 p -54.16 148.24 2.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.357 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.5 -65.95 0.94 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.968 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -177.01 -39.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.024 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -55.75 131.22 46.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.059 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.0 p -135.13 126.07 45.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.014 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -82.69 142.53 31.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.85 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 60.58 95.42 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.97 177.43 5.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.888 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.122 -179.965 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.873 0.368 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.34 -50.29 5.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.888 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.76 -60.28 2.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.075 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.06 74.4 0.39 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.033 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.465 ' HA ' ' CG1' ' A' ' 57' ' ' VAL . 1.5 mt -147.1 -96.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.5 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.525 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 0.2 OUTLIER 37.67 -142.77 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 179.077 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.67 -64.15 0.19 Allowed 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.468 ' CG1' ' HA ' ' A' ' 54' ' ' LEU . 34.6 t -50.6 -37.14 15.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.779 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.648 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.3 pt-20 -61.28 -48.09 83.02 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 0.2 OUTLIER -66.33 -15.46 63.27 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.521 177.762 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 28.8 ttm-85 -73.01 -71.26 0.31 Allowed 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.63 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -64.53 -27.45 68.97 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.842 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.441 ' HB2' ' CD1' ' A' ' 61' ' ' LEU . 1.9 tt0 -68.53 -33.52 74.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.503 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.0 OUTLIER -81.49 -19.2 42.78 Favored 'General case' 0 C--O 1.231 0.109 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.616 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.416 HD22 ' N ' ' B' ' 65' ' ' GLU . 0.0 OUTLIER -83.01 -23.95 33.05 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.244 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -94.06 -65.15 1.01 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.599 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 67' ' ' LEU . 0.0 OUTLIER -64.4 133.97 53.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.214 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.437 ' CB ' ' O ' ' B' ' 66' ' ' GLN . 0.5 OUTLIER 83.33 -45.74 0.12 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.756 -179.328 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.68 88.48 3.23 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.867 0.365 . . . . 0.0 110.586 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -158.11 160.09 36.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.59 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 14.7 mt -59.64 -19.56 50.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.273 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 15.7 mm -124.98 27.53 2.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.595 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . 0.419 ' CE2' ' HB2' ' B' ' 74' ' ' ARG . 5.1 p90 -58.04 137.34 84.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.966 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.568 2.179 . . . . 0.0 112.283 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . 0.419 ' HB2' ' CE2' ' B' ' 72' ' ' PHE . 0.0 OUTLIER -168.96 -65.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.114 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -125.31 122.83 37.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.19 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 p30 -66.89 173.73 3.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.789 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp 177.56 -30.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.177 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 64.17 69.24 0.53 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.902 0.382 . . . . 0.0 110.696 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 29.1 mtp -65.16 -49.3 70.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.675 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.0 mp -76.43 -41.25 35.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.15 -30.19 69.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.558 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.58 -29.7 18.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.296 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.76 -24.3 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.712 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.64 96.57 10.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.638 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 5.4 m -54.01 109.82 0.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 3.2 pp -139.43 26.67 2.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.992 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.74 -21.92 13.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.922 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' B' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -6.97 49.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.061 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.457 ' CD1' ' N ' ' B' ' 89' ' ' ILE . 2.6 mp -91.79 -54.03 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -20.8 66.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.237 177.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.35 -56.69 3.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.247 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.407 ' CB ' ' O ' ' B' ' 88' ' ' ASP . 33.4 tp -54.82 -24.1 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.97 0.414 . . . . 0.0 109.908 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 11.1 mt -92.28 -39.57 11.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.47 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.94 61.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.13 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.06 -40.84 0.47 Allowed Glycine 0 CA--C 1.519 0.3 0 C-N-CA 120.42 -0.895 . . . . 0.0 113.354 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.76 -0.45 15.95 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 30.0 p90 39.52 53.43 2.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.571 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 p -54.06 148.23 2.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.353 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.55 -65.93 0.95 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.939 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -177.02 -39.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.938 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -55.67 131.13 45.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.063 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 12.0 p -135.06 125.99 45.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.043 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -82.59 142.53 31.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.833 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt 60.66 95.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.87 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.89 177.42 5.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.944 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.213 -0.898 . . . . 0.0 111.126 179.946 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.803 0.335 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -59.89 110.24 1.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.966 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.66 157.46 42.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.23 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -116.75 -66.49 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.63 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.481 ' HA ' ' CG1' ' B' ' 57' ' ' VAL . 5.0 mp -54.62 -81.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.409 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 13.2 t 42.72 -151.19 0.03 OUTLIER 'General case' 0 C--O 1.24 0.576 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 178.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 15.1 mt-10 -38.02 -41.46 0.56 Allowed 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.575 -178.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.49 ' CG1' ' HA ' ' B' ' 54' ' ' LEU . 51.6 t -64.44 -42.74 96.16 Favored 'Isoleucine or valine' 0 C--O 1.251 1.143 0 CA-C-O 121.362 0.601 . . . . 0.0 110.922 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.567 ' CA ' HD21 ' B' ' 61' ' ' LEU . 1.1 pt-20 -59.04 -54.5 46.34 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.503 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 94.0 p -61.67 -17.56 56.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.657 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.443 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.8 -71.49 0.22 Allowed 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.871 -179.115 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.566 HD21 ' CA ' ' B' ' 58' ' ' GLU . 0.0 OUTLIER -67.8 -19.97 65.14 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.787 -179.335 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.462 ' HB2' HD22 ' B' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.21 77.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.901 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.6 mtp85 -85.78 -18.66 32.34 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.215 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -75.85 -34.22 60.06 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.144 0.497 . . . . 0.0 110.407 179.639 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.493 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 0.5 OUTLIER -96.49 -28.84 14.22 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.129 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.03 42.31 3.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.127 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.31 119.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.26 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.459 ' HB2' ' CD2' ' B' ' 68' ' ' PHE . 4.0 t80 -151.4 124.0 8.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.985 0.422 . . . . 0.0 110.971 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tp -175.23 -39.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.07 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -103.82 26.01 9.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.416 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 21.6 mt -114.01 -24.87 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.173 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 63.45 123.36 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.732 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -84.17 87.11 1.19 Allowed 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.683 2.255 . . . . 0.0 112.654 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.7 mtp-105 56.47 34.12 23.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.243 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.85 104.54 14.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 75.4 -76.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.6 mp 53.95 68.2 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.026 0.441 . . . . 0.0 110.88 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -114.3 -19.02 11.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.674 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.1 -40.81 74.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.742 0.306 . . . . 0.0 111.045 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mm -67.3 -44.11 87.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.117 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.27 -24.3 67.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.921 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.07 -26.81 22.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.937 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 39.7 mtp -85.17 -20.28 30.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.101 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -99.5 28.02 4.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.77 0.319 . . . . 0.0 110.98 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 168.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.061 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.5 mt -176.09 -40.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.897 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.92 -30.62 22.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.811 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.06 -9.93 58.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.169 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.466 ' N ' ' CD1' ' A' ' 89' ' ' ILE . 2.4 mp -91.65 -55.97 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.54 -20.9 65.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.524 -0.762 . . . . 0.0 108.982 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.2 -49.98 6.91 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.883 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.4 mt -53.97 -26.75 27.43 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.425 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 3.8 mm? -91.9 -36.88 13.22 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.997 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.19 -14.82 57.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.964 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.47 -29.79 1.26 Allowed Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.498 -0.858 . . . . 0.0 113.21 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -100.12 2.87 43.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.962 0.381 . . . . 0.0 111.956 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.425 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 24.5 p90 -38.89 137.54 0.65 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.679 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.7 t -141.98 140.69 29.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.991 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -72.86 130.49 40.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.968 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -134.86 150.61 50.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.915 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -57.21 5.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.803 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.8 m -80.21 138.8 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.151 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -97.95 -34.62 10.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.887 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -110.2 113.33 25.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -148.3 31.36 0.83 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.904 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.128 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.797 0.332 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 33.9 mtt85 -149.66 60.42 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.826 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.61 157.32 42.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.203 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -116.71 -66.27 1.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.725 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.49 ' HA ' ' CG1' ' A' ' 57' ' ' VAL . 5.0 mp -54.72 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.726 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.406 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 13.3 t 42.81 -151.25 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -38.04 -41.37 0.56 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.613 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.481 ' CG1' ' HA ' ' A' ' 54' ' ' LEU . 52.5 t -64.46 -42.87 96.52 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.297 0.57 . . . . 0.0 110.798 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.566 ' CA ' HD21 ' A' ' 61' ' ' LEU . 1.1 pt-20 -58.97 -54.65 44.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.509 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 94.1 p -61.47 -17.73 55.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.728 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.438 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.65 -71.63 0.21 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.857 -179.132 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.567 HD21 ' CA ' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -67.69 -19.97 65.23 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.834 -179.281 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.473 ' HB2' HD22 ' A' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.25 77.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.886 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.6 mtp85 -85.7 -18.69 32.38 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.169 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.53 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -75.88 -34.16 59.99 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.14 0.495 . . . . 0.0 110.365 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 0.5 OUTLIER -96.64 -28.78 14.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.115 179.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 65.83 42.47 3.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.22 118.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . 0.459 ' CD2' ' HB2' ' A' ' 68' ' ' PHE . 4.0 t80 -151.28 123.64 8.34 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.024 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -174.75 -39.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.075 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mt -104.16 26.14 9.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.159 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . 0.415 ' HB ' ' CE1' ' B' ' 68' ' ' PHE . 21.4 mt -113.98 -24.82 3.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.246 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 63.54 123.28 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.696 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -84.3 86.92 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.778 2.318 . . . . 0.0 112.552 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.0 mtp-105 53.88 24.45 4.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.805 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -83.79 -73.55 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.342 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.91 88.16 2.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.937 0.398 . . . . 0.0 110.755 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.63 67.97 0.92 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -105.64 -19.8 13.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -40.75 75.29 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 34.9 mm -67.34 -44.2 87.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.018 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mp -65.33 -24.09 67.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.19 -26.82 22.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.98 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 39.8 mtp -85.1 -20.37 30.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.15 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -99.48 28.13 4.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.073 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t 57.45 168.05 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -176.06 -40.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.926 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.75 -30.74 22.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.91 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.89 -10.13 59.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.459 ' CD1' ' N ' ' B' ' 89' ' ' ILE . 2.5 mp -91.57 -56.01 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -62.52 -20.9 65.08 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.045 177.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 -49.92 6.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.0 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 4.4 mt -54.01 -26.74 27.77 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.429 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 3.8 mm? -91.84 -36.92 13.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.013 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.12 -14.87 57.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.986 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.41 -29.96 1.24 Allowed Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.199 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -100.04 2.87 43.76 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.429 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 24.4 p90 -38.82 137.5 0.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.643 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.7 t -142.0 140.7 29.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.929 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -72.89 130.38 40.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.893 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -134.82 150.6 50.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.903 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -57.33 5.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.739 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 11.9 m -80.22 138.93 18.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.095 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -98.09 -34.35 10.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.938 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.5 mtpm? -110.46 113.25 25.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.798 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -148.22 31.32 0.84 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.954 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.04 179.968 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.812 0.339 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.6 ttt85 -123.84 -73.24 0.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.927 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -136.24 28.51 3.1 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.251 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -126.62 85.38 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.776 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.509 ' O ' ' N ' ' A' ' 56' ' ' GLU . 19.6 tp -172.7 -100.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.017 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.493 ' C ' ' O ' ' A' ' 54' ' ' LEU . 38.4 m 6.35 -72.75 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -59.96 -68.52 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.997 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.491 ' CG1' ' HB ' ' B' ' 57' ' ' VAL . 24.5 t -55.53 -48.56 77.2 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.587 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.2 pt-20 -51.72 -47.29 64.06 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.387 0.613 . . . . 0.0 109.469 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.414 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 4.9 t -67.61 -19.51 65.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.577 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -69.21 -68.53 0.4 Allowed 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.466 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.645 ' HG ' ' HB2' ' B' ' 62' ' ' GLU . 3.6 mm? -62.91 -42.46 99.8 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.802 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.623 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 69.7 tt0 -50.8 -35.96 34.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.255 177.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.45 -26.59 46.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.913 0.387 . . . . 0.0 110.035 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -27.16 68.3 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.3 0.571 . . . . 0.0 109.742 179.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 66' ' ' GLN . 25.2 tt0 -99.56 -21.23 15.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.882 178.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 65' ' ' GLU . 17.3 pt20 50.53 35.26 10.92 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.482 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.445 ' O ' ' CB ' ' A' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 11.0 7.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.925 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.457 ' CE1' ' CD2' ' B' ' 69' ' ' LEU . 0.4 OUTLIER 158.58 137.69 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.471 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.453 ' HG ' ' CG2' ' A' ' 71' ' ' ILE . 0.7 OUTLIER -66.42 -165.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.34 179.458 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.74 -15.51 58.74 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.453 ' CG2' ' HG ' ' A' ' 69' ' ' LEU . 0.7 OUTLIER -57.18 -28.86 30.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.716 0.293 . . . . 0.0 111.539 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.19 92.95 5.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.164 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.75 -7.6 21.04 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.579 2.186 . . . . 0.0 112.663 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 65.9 49.71 1.61 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.351 . . . . 0.0 110.918 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -176.27 -51.04 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -108.59 135.07 50.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.961 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 pp -109.36 30.12 6.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.96 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 30.54 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -49.72 57.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.9 mm -61.72 -45.51 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.989 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 mt -66.11 -30.4 70.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.524 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -74.86 -28.97 60.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.855 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.03 -73.93 0.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.577 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.39 116.4 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.624 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 75.49 -161.93 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.777 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 64.92 26.07 12.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.751 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -148.94 -40.88 0.15 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.912 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.22 -8.3 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.881 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.449 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 13.0 mm -89.36 -56.87 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.479 ' O ' ' HB ' ' A' ' 94' ' ' THR . 2.5 tm-20 -64.89 -19.88 66.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.493 178.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.41 ' HA ' ' CG2' ' A' ' 94' ' ' THR . . . -87.48 -58.74 2.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.641 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 25.5 tp -55.85 -24.27 35.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.289 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 1.0 OUTLIER -92.38 -39.79 11.25 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.066 179.668 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.479 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 11.4 t -69.94 -11.49 60.91 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.898 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.33 -35.85 1.06 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.753 -0.737 . . . . 0.0 113.19 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.71 -5.42 42.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 117.015 0.408 . . . . 0.0 112.015 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.426 ' CD2' ' O ' ' A' ' 97' ' ' PHE . 25.6 p90 37.26 93.97 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.033 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 12.2 p -105.03 113.93 43.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.184 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.44 154.14 18.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.98 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -159.57 143.79 14.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.886 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -103.13 136.6 42.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.009 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 5.9 m -148.7 -47.19 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.057 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -92.85 128.47 38.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.862 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.81 139.45 46.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.852 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.8 t0 57.7 101.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.18 -179.944 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.861 0.362 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.04 57.89 0.66 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.689 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -133.74 28.28 3.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.288 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -126.54 85.43 2.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' B' ' 56' ' ' GLU . 19.7 tp -172.81 -100.37 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.028 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.483 ' C ' ' O ' ' B' ' 54' ' ' LEU . 38.9 m 6.46 -72.87 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -59.95 -68.53 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.007 -178.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.491 ' HB ' ' CG1' ' A' ' 57' ' ' VAL . 25.0 t -55.68 -48.17 78.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.714 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.609 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 pt-20 -52.01 -47.28 65.04 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.425 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 4.8 t -67.41 -19.56 65.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.666 178.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -69.26 -68.59 0.39 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.426 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.623 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 3.6 mm? -62.9 -42.43 99.78 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 119.377 -0.929 . . . . 0.0 108.742 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.645 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 69.7 tt0 -50.85 -35.83 34.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.249 177.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.6 -26.57 45.43 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.918 0.39 . . . . 0.0 110.014 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -27.2 68.37 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.336 0.588 . . . . 0.0 109.723 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.423 ' O ' ' CG ' ' B' ' 66' ' ' GLN . 25.3 tt0 -99.54 -21.35 15.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.837 178.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' B' ' 65' ' ' GLU . 17.3 pt20 50.53 35.32 11.07 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.47 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.45 ' O ' ' CB ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 10.8 7.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.958 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . 0.45 ' CB ' ' O ' ' B' ' 67' ' ' LEU . 0.3 OUTLIER 158.78 138.61 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.632 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.457 ' CD2' ' CE1' ' A' ' 68' ' ' PHE . 2.4 tp -66.06 -166.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.439 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 15.8 mt -63.7 -15.44 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.345 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.24 -28.66 30.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.715 0.293 . . . . 0.0 111.549 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.28 93.09 5.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.169 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.82 -7.63 21.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.62 2.213 . . . . 0.0 112.695 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 65.74 49.27 1.75 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.922 0.391 . . . . 0.0 110.836 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -170.64 -61.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.835 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -105.35 139.47 39.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.754 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.03 34.16 3.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.5 30.41 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -49.75 56.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 38.0 mm -61.72 -45.49 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mt -66.05 -30.39 70.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.585 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -75.0 -28.82 60.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.04 -73.92 0.43 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.651 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.36 116.35 10.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.597 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 75.67 -162.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.692 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 mm? 64.85 26.18 12.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.847 0.356 . . . . 0.0 110.723 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -148.96 -40.91 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.802 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.27 -8.16 51.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.884 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.45 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 12.9 mm -89.37 -56.96 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.485 ' O ' ' HB ' ' B' ' 94' ' ' THR . 2.4 tm-20 -64.93 -19.91 66.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.432 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . 0.416 ' HA ' ' CG2' ' B' ' 94' ' ' THR . . . -87.33 -58.69 2.49 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.78 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 25.8 tp -55.8 -24.36 35.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.288 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 1.0 OUTLIER -92.25 -39.89 11.27 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.08 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.485 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 11.5 t -69.97 -11.47 60.9 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.895 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.4 -35.89 1.05 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.106 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.62 -5.39 42.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 117.162 0.481 . . . . 0.0 112.105 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.431 ' CD2' ' O ' ' B' ' 97' ' ' PHE . 25.9 p90 37.25 94.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.13 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . 0.402 ' CG1' ' CD2' ' B' ' 93' ' ' LEU . 12.1 p -105.13 113.85 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.19 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.33 154.28 18.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.927 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -159.7 143.75 14.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -103.13 136.45 42.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.8 m -148.53 -47.17 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.09 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 12.5 m-20 -92.92 128.58 38.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.805 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.86 138.78 46.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 1.8 t0 58.26 101.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.929 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.109 -179.99 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.454 ' CG2' ' CE1' ' B' ' 53' ' ' HIS . 74.2 p . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.707 0.289 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.8 mtm180 -167.31 -49.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.023 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -165.14 79.42 0.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.328 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.422 ' CE1' ' HA ' ' A' ' 50' ' ' THR . 2.0 p-80 -157.27 27.46 0.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.979 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.431 HD11 ' N ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -101.13 -0.46 36.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.59 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.508 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -56.32 -53.41 57.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.79 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.14 -42.05 63.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.459 ' HB ' ' CG1' ' B' ' 57' ' ' VAL . 2.9 t -62.59 -41.1 90.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.628 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.572 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 2.4 mt-10 -56.61 -64.1 0.98 Allowed 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.6 m -52.88 -20.51 3.37 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.118 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.451 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.01 -73.25 0.15 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.159 -179.31 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.6 mm? -61.83 -24.42 66.88 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.145 -1.022 . . . . 0.0 110.208 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.404 ' HB2' HD13 ' B' ' 61' ' ' LEU . 24.3 tt0 -65.28 -37.19 86.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.49 177.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -20.39 53.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.522 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.515 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -74.47 -32.07 62.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.46 0.647 . . . . 0.0 110.386 179.404 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.446 ' CB ' ' CB ' ' B' ' 65' ' ' GLU . 3.3 mm-40 -92.81 -23.71 18.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.623 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -58.74 -39.03 79.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.017 0.437 . . . . 0.0 110.366 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 tt -76.46 -11.42 59.88 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.969 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 31.5 t80 76.57 130.93 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.91 0.386 . . . . 0.0 111.123 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -145.15 61.04 1.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.737 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.7 52.47 13.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.149 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.405 ' CD1' ' HG2' ' B' ' 66' ' ' GLN . 6.5 tp -99.43 -41.08 9.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.097 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -78.57 113.52 35.31 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.836 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.1 134.36 59.73 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.361 2.041 . . . . 0.0 112.255 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.6 mtm180 -156.38 89.01 1.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -73.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -95.51 121.57 37.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.226 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp 53.9 100.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.128 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.421 ' CB ' ' CD2' ' A' ' 81' ' ' LEU . 13.1 m-20 -75.69 96.3 3.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 28.5 mtt -62.5 -25.82 68.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.901 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.03 -55.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.403 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.421 ' CD2' ' CB ' ' A' ' 78' ' ' ASP . 0.4 OUTLIER -81.52 -15.68 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -179.874 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.37 -25.98 38.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.814 0.34 . . . . 0.0 110.744 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.54 -22.86 12.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.89 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.04 -68.46 0.44 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.746 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 p -147.88 -92.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.96 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 12.8 tp 44.78 29.78 0.47 Allowed 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 120.783 0.325 . . . . 0.0 111.414 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.77 -33.42 1.82 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.361 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.77 -10.29 57.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.668 0.27 . . . . 0.0 111.242 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 21.3 mm -88.71 -53.89 8.76 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.436 ' O ' ' HB ' ' A' ' 94' ' ' THR . 33.2 tt0 -67.49 -16.81 64.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.184 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.451 ' HA ' ' CG2' ' A' ' 94' ' ' THR . . . -88.02 -47.86 8.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.212 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 10.4 mt -64.08 -24.19 67.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.159 0.504 . . . . 0.0 109.756 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.443 ' HB3' ' HB3' ' B' ' 93' ' ' LEU . 1.3 mm? -91.26 -36.85 13.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.795 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.451 ' CG2' ' HA ' ' A' ' 91' ' ' ALA . 9.0 t -75.51 -13.02 60.35 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.0 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.65 -31.11 1.86 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.251 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.96 -0.11 12.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 117.151 0.475 . . . . 0.0 112.144 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.511 ' CD1' ' N ' ' A' ' 97' ' ' PHE . 0.1 OUTLIER 36.14 -92.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.279 179.485 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.6 t -57.57 155.6 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.252 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -177.64 90.17 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.847 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -128.1 10.55 6.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.29 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 54.65 -172.76 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.82 0.343 . . . . 0.0 111.144 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 10.8 p -114.88 148.06 17.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.935 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 32.0 m120 60.33 -179.38 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.757 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -153.78 -49.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.691 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -58.84 -47.01 86.36 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.088 179.904 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.899 0.38 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.13 -57.69 1.99 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.783 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.99 78.99 0.46 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.024 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . 0.454 ' CE1' ' CG2' ' A' ' 50' ' ' THR . 2.0 p-80 -157.28 27.46 0.3 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.986 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.432 HD11 ' N ' ' B' ' 55' ' ' THR . 0.0 OUTLIER -101.25 -0.44 35.81 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.605 -179.876 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.505 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -56.33 -53.38 57.94 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.204 0.526 . . . . 0.0 110.778 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.16 -42.13 63.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.662 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.459 ' CG1' ' HB ' ' A' ' 57' ' ' VAL . 2.9 t -62.65 -40.96 90.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.646 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 2.4 mt-10 -56.66 -64.03 1.0 Allowed 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 43.5 m -52.93 -20.45 3.38 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.138 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.446 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.13 -73.14 0.15 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.156 -179.331 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.6 mm? -61.9 -24.34 66.89 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.2 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -65.5 -37.05 85.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -20.4 53.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.566 178.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.534 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -74.63 -31.95 62.14 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.36 0.6 . . . . 0.0 110.328 179.506 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.446 ' CB ' ' CB ' ' A' ' 65' ' ' GLU . 3.3 mm-40 -92.81 -23.62 18.78 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.718 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 0.405 ' HG2' ' CD1' ' A' ' 71' ' ' ILE . 7.6 mt-30 -58.77 -39.16 80.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.309 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 9.2 tt -76.43 -11.41 59.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.025 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 31.3 t80 76.48 130.99 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.877 0.37 . . . . 0.0 111.216 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.48 60.98 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.0 52.46 12.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.5 tp -99.37 -41.07 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.248 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -78.48 113.54 35.26 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.905 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.05 134.17 58.64 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.416 2.078 . . . . 0.0 112.266 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -155.85 87.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.798 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -163.67 102.33 0.92 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.468 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 66.45 127.08 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.471 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.74 69.56 0.5 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.02 0.438 . . . . 0.0 110.704 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . 0.412 ' CB ' ' CD2' ' B' ' 81' ' ' LEU . 12.9 m-20 -72.02 97.25 1.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.643 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 28.2 mtt -62.64 -25.7 68.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.1 -55.77 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.346 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.412 ' CD2' ' CB ' ' B' ' 78' ' ' ASP . 0.4 OUTLIER -81.71 -15.53 54.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.484 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.41 -26.01 38.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.788 0.327 . . . . 0.0 110.75 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.53 -22.82 12.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.0 -68.57 0.43 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.715 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 p -147.86 -92.2 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.91 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 9.1 tp 44.82 29.76 0.48 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.79 0.328 . . . . 0.0 111.358 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.92 -33.35 1.79 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.387 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.72 -10.33 57.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.34 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 20.9 mm -88.48 -53.9 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.426 ' O ' ' HB ' ' B' ' 94' ' ' THR . 33.2 tt0 -67.65 -16.78 64.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.185 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . 0.448 ' HA ' ' CG2' ' B' ' 94' ' ' THR . . . -88.0 -47.73 8.31 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.332 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.21 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.135 0.493 . . . . 0.0 109.713 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 93' ' ' LEU . 1.3 mm? -91.29 -36.95 13.58 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.773 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.448 ' CG2' ' HA ' ' B' ' 91' ' ' ALA . 9.1 t -75.44 -13.1 60.37 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.033 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.59 -31.04 1.88 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.398 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.9 -0.11 12.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 117.154 0.477 . . . . 0.0 112.273 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.516 ' N ' ' CD1' ' B' ' 97' ' ' PHE . 0.1 OUTLIER 36.05 -92.87 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.272 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.5 t -57.63 155.58 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.844 0.354 . . . . 0.0 111.308 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -177.58 90.27 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -128.14 10.5 6.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.333 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 54.76 -172.86 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.796 0.332 . . . . 0.0 111.007 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.8 p -114.82 148.12 17.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.926 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 32.3 m120 60.33 -179.62 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.882 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -153.46 -49.7 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.718 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -58.85 -47.12 86.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.77 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.114 179.999 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.761 0.315 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.26 172.24 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.883 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.49 -76.16 0.52 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.117 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -144.87 136.97 25.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.034 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.462 ' O ' ' N ' ' A' ' 57' ' ' VAL . 5.0 mp -110.5 -57.52 2.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.618 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.423 ' C ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -21.04 -55.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 1.7 mm-40 -58.68 -50.84 72.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.266 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.547 ' HB ' ' HB ' ' B' ' 57' ' ' VAL . 6.1 t -63.92 -53.81 39.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.39 -179.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HB2' HD23 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.58 -62.39 1.68 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.437 ' HA ' HD21 ' B' ' 61' ' ' LEU . 29.9 t -48.72 -28.03 3.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.64 177.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 8.7 tpt180 -60.74 -63.86 1.15 Allowed 'General case' 0 C--O 1.242 0.694 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.889 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.751 HD21 ' HB2' ' B' ' 62' ' ' GLU . 1.0 OUTLIER -63.03 -18.22 63.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 118.1 -1.44 . . . . 0.0 109.71 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.759 ' HB2' HD21 ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.34 -37.66 87.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.722 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -68.91 -31.6 70.62 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.523 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -63.21 -30.15 71.35 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.086 177.67 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.408 ' N ' HD22 ' A' ' 64' ' ' LEU . 0.6 OUTLIER -80.18 -31.44 38.81 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.049 179.159 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -55.74 -35.93 66.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.56 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.01 -29.99 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.524 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.58 102.96 0.78 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.772 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.1 -72.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.26 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.9 mt -140.48 53.48 1.62 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.85 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 7.1 tt 42.84 32.18 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.54 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.15 67.49 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.2 163.91 1.42 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.523 2.149 . . . . 0.0 112.35 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.21 89.34 7.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -159.96 152.08 20.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -80.87 90.18 5.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.9 mp -118.91 175.36 5.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.793 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.431 ' HB2' ' HB2' ' A' ' 81' ' ' LEU . 7.0 p-10 -137.08 59.71 1.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -45.92 77.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.015 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -57.16 -39.79 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.861 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.431 ' HB2' ' HB2' ' A' ' 78' ' ' ASP . 9.3 mp -71.38 -27.91 63.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.788 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.16 -23.3 44.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 16.4 mtp -95.96 -21.11 18.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.247 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.57 -2.74 37.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.412 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.55 143.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.946 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 9.7 tp -149.62 26.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.958 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -116.14 -15.96 11.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.287 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.46 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 67.4 m-20 -71.08 -10.06 59.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.649 0.262 . . . . 0.0 111.22 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 20.2 mm -89.68 -55.36 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.47 ' O ' ' HB ' ' A' ' 94' ' ' THR . 20.0 tt0 -66.23 -17.58 64.83 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.275 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.415 ' HA ' ' CG2' ' A' ' 94' ' ' THR . . . -87.94 -55.35 3.8 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.555 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 3.2 mm? -58.98 -23.44 61.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.115 0.483 . . . . 0.0 110.051 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.43 -40.92 11.15 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.046 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.47 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 10.5 t -71.01 -11.73 61.13 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.226 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.71 -33.64 1.27 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.122 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.01 -2.86 33.4 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.41 ' CD2' ' O ' ' A' ' 97' ' ' PHE . 17.6 p90 40.35 79.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.688 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.6 t -88.21 104.57 14.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.109 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -106.13 -68.89 0.85 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.983 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.59 155.34 36.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.927 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -115.35 179.35 3.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.902 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 23.1 t -76.1 -41.71 37.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.076 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -154.52 93.5 1.59 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -133.86 -57.8 0.87 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.944 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -161.11 112.43 1.8 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.939 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.067 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.872 0.368 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 -177.0 76.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.762 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.33 -76.21 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.243 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -144.85 137.02 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.043 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.459 ' O ' ' N ' ' B' ' 57' ' ' VAL . 5.0 mp -110.54 -57.51 2.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.641 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.434 ' C ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -20.98 -55.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 179.977 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 1.7 mm-40 -58.7 -50.86 72.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.841 0.353 . . . . 0.0 111.287 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.547 ' HB ' ' HB ' ' A' ' 57' ' ' VAL . 6.1 t -63.8 -53.84 39.43 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.428 ' O ' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.56 -62.4 1.68 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.429 ' HA ' HD21 ' A' ' 61' ' ' LEU . 30.1 t -48.73 -28.14 3.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.567 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.527 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 8.7 tpt180 -60.6 -63.83 1.16 Allowed 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.991 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.759 HD21 ' HB2' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -63.18 -18.07 63.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.111 -1.436 . . . . 0.0 109.808 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.751 ' HB2' HD21 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -65.38 -37.67 87.71 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 175.616 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -68.96 -31.52 70.45 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.544 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -63.16 -30.29 71.47 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.05 177.653 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.413 ' N ' HD22 ' B' ' 64' ' ' LEU . 0.6 OUTLIER -80.21 -31.32 38.68 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.638 -1.165 . . . . 0.0 110.125 179.147 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -55.86 -35.87 66.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.563 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -29.87 63.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.541 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.64 103.2 0.83 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.647 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 43.7 tp -54.26 -72.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.23 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 4.8 mt -140.36 53.46 1.63 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.907 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 7.1 tt 42.88 32.1 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.651 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.11 67.58 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.927 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.27 163.92 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.596 2.197 . . . . 0.0 112.28 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.15 89.32 7.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -159.98 151.51 19.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.75 90.07 5.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.58 175.96 5.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 6.9 p-10 -137.33 59.69 1.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.857 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -45.83 77.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.091 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.7 mm -57.14 -39.83 69.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.433 ' HB2' ' HB2' ' B' ' 78' ' ' ASP . 9.3 mp -71.32 -27.99 63.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.753 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.1 -23.38 44.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.162 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 16.3 mtp -95.93 -21.13 18.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.186 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.5 -2.83 37.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.378 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.53 144.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.829 0.347 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -149.8 26.02 0.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.952 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -115.92 -16.13 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.276 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 67.7 m-20 -70.99 -10.08 59.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.736 0.303 . . . . 0.0 111.261 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 20.1 mm -89.63 -55.42 6.3 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.459 ' O ' ' HB ' ' B' ' 94' ' ' THR . 20.0 tt0 -66.13 -17.78 64.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.217 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . 0.418 ' HA ' ' CG2' ' B' ' 94' ' ' THR . . . -87.92 -55.33 3.81 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.553 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 3.2 mm? -59.05 -23.44 62.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.48 -40.8 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.968 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.459 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 10.6 t -71.16 -11.7 61.08 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.138 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.73 -33.72 1.26 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.756 -0.735 . . . . 0.0 113.044 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.07 -2.8 33.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 117.002 0.401 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.411 ' CD2' ' O ' ' B' ' 97' ' ' PHE . 17.6 p90 40.46 79.55 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.671 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.5 t -88.14 104.51 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.163 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -106.12 -69.0 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.925 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.51 155.37 35.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.92 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -115.37 179.29 4.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.787 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 23.0 t -76.03 -41.71 38.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.12 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -154.62 93.52 1.59 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.85 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -133.86 -57.76 0.87 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.965 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -161.11 112.33 1.79 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.897 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.13 179.937 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.829 0.347 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -61.33 131.18 49.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.074 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.57 120.24 8.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.831 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.44 ' CD2' ' CB ' ' B' ' 56' ' ' GLU . 0.2 OUTLIER -145.49 76.61 1.48 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.096 -179.493 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 56' ' ' GLU . 0.5 OUTLIER -177.65 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 116.719 -0.218 . . . . 0.0 111.13 -179.623 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.446 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.2 m 24.8 -85.3 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.435 ' CB ' ' CD2' ' B' ' 53' ' ' HIS . 4.0 mm-40 -62.74 -68.03 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.893 0.378 . . . . 0.0 111.744 -178.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.519 ' CG1' ' HB ' ' B' ' 57' ' ' VAL . 1.9 t -55.94 -44.55 78.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.289 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.699 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.1 pt-20 -52.98 -48.19 67.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.452 0.644 . . . . 0.0 109.452 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 27.8 t -66.39 -20.16 65.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.636 178.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 2.2 tpm_? -70.01 -71.73 0.23 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.832 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.683 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.5 mm? -61.21 -38.77 87.77 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.245 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.541 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 8.0 tt0 -53.41 -39.44 64.32 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.795 176.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.1 OUTLIER -70.25 -28.54 65.32 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.865 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.575 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.35 68.92 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 68' ' ' PHE . 30.0 tt0 -88.63 -25.48 22.4 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.355 178.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.27 -76.73 0.06 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.924 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.36 42.09 1.87 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.422 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.456 ' HA ' ' HG2' ' A' ' 65' ' ' GLU . 31.7 p90 -39.46 104.84 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.988 0.423 . . . . 0.0 111.546 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.91 -66.69 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.789 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 71.3 mt -150.27 -79.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.989 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.92 24.65 4.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.378 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.96 91.02 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.011 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.25 108.51 2.0 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.531 2.154 . . . . 0.0 112.304 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.04 146.89 32.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 55.97 177.72 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.078 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -125.12 37.45 4.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.88 35.38 1.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.856 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.21 20.33 15.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.99 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.15 -28.69 66.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 110.679 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 26.9 mm -79.46 -45.72 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.43 -24.65 63.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.191 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.27 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.913 0.387 . . . . 0.0 110.891 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 44.4 mtp -57.98 -25.39 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.258 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.03 -59.02 0.45 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.035 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 m 64.53 -163.42 0.26 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.801 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 mt 70.41 30.28 3.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.33 -53.07 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.699 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.5 m-20 -70.5 -11.43 60.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.919 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 26.4 mm -90.3 -52.06 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.476 ' O ' ' HB ' ' A' ' 94' ' ' THR . 1.5 tt0 -66.02 -17.95 65.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.033 177.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.43 ' HA ' ' CG2' ' A' ' 94' ' ' THR . . . -87.89 -53.6 4.67 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.583 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.422 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 6.1 mp -61.13 -21.22 63.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.054 0.454 . . . . 0.0 110.156 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.429 ' HB3' ' HB3' ' B' ' 93' ' ' LEU . 7.5 mp -94.52 -38.45 10.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.862 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.476 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 12.3 t -72.28 -13.47 61.51 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.909 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.36 -32.32 1.06 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.146 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.472 ' O ' ' CG ' ' A' ' 97' ' ' PHE . 0.4 OUTLIER -115.67 5.59 14.31 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.518 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.472 ' CG ' ' O ' ' A' ' 96' ' ' LEU . 39.0 p90 46.22 -145.21 0.21 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.355 -179.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 12.4 p -80.03 158.25 4.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.855 0.359 . . . . 0.0 111.166 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 63.03 144.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -110.38 -33.57 6.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.906 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.79 34.7 19.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.841 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.1 p -136.59 158.48 37.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.143 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -65.46 107.66 1.74 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.911 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.52 142.15 48.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.912 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -170.89 165.57 7.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.855 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.298 -0.858 . . . . 0.0 111.116 179.927 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 31.9 m . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.673 0.273 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -175.34 53.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.089 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.29 119.83 7.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.855 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . 0.435 ' CD2' ' CB ' ' A' ' 56' ' ' GLU . 0.2 OUTLIER -145.32 76.71 1.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.989 -179.476 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.427 ' O ' ' N ' ' B' ' 56' ' ' GLU . 0.5 OUTLIER -177.72 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.151 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.455 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.3 m 24.93 -85.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.44 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 4.0 mm-40 -62.84 -67.97 0.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.873 0.368 . . . . 0.0 111.705 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.519 ' HB ' ' CG1' ' A' ' 57' ' ' VAL . 1.9 t -55.9 -44.71 78.83 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.177 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.683 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.1 pt-20 -52.9 -48.23 67.36 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.429 0.633 . . . . 0.0 109.49 179.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.468 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 28.0 t -66.29 -20.24 66.05 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.61 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -69.97 -71.71 0.23 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.891 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.5 mm? -61.3 -38.7 87.75 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.427 -0.909 . . . . 0.0 109.169 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.532 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 8.0 tt0 -53.56 -39.32 64.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.765 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.1 OUTLIER -70.26 -28.59 65.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.563 ' HB3' ' O ' ' B' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.43 68.97 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.508 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.45 ' HG2' ' HA ' ' B' ' 68' ' ' PHE . 29.6 tt0 -88.43 -25.65 22.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.45 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -76.83 0.06 Allowed 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.815 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.43 42.21 1.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.35 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . 0.45 ' HA ' ' HG2' ' B' ' 65' ' ' GLU . 31.8 p90 -39.43 104.73 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.859 0.361 . . . . 0.0 111.593 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 8.0 tt -145.91 -66.32 0.3 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.891 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 71.7 mt -150.49 -79.43 0.12 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.88 24.6 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.316 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.98 90.96 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.007 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -69.36 108.57 2.03 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.358 2.039 . . . . 0.0 112.273 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.98 146.92 32.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.963 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -57.95 88.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 p30 -131.07 23.38 4.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.82 89.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.227 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -113.9 20.09 16.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.83 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.2 -28.74 66.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.657 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 26.6 mm -79.28 -45.94 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.858 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.26 -24.66 64.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.29 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.24 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 44.6 mtp -57.94 -25.47 60.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.226 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.05 -59.11 0.45 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.781 0.324 . . . . 0.0 111.019 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 m 64.68 -163.48 0.26 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.829 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 70.34 30.21 3.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.08 -53.04 0.91 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.728 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.5 m-20 -70.56 -11.42 60.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.881 0.372 . . . . 0.0 110.934 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 26.5 mm -90.3 -52.0 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.468 ' O ' ' HB ' ' B' ' 94' ' ' THR . 1.5 tt0 -66.02 -17.87 64.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.086 177.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . 0.431 ' HA ' ' CG2' ' B' ' 94' ' ' THR . . . -87.92 -53.66 4.63 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.588 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 6.1 mp -61.02 -21.35 63.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.423 . . . . 0.0 110.0 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.429 ' HB3' ' HB3' ' A' ' 93' ' ' LEU . 7.5 mp -94.62 -38.33 10.9 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 12.4 t -72.29 -13.43 61.5 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.889 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.32 -32.36 1.06 Allowed Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.151 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.478 ' O ' ' CG ' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -115.64 5.59 14.34 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.478 ' CG ' ' O ' ' B' ' 96' ' ' LEU . 39.0 p90 46.34 -145.28 0.22 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.327 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 12.5 p -79.92 158.19 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.814 0.34 . . . . 0.0 111.22 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 63.07 144.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.881 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -110.46 -33.44 6.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.874 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.78 34.62 19.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.84 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 11.0 p -136.55 158.46 37.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.07 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -65.47 107.66 1.75 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.863 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 17.3 tttt -72.55 142.34 48.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.888 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -170.99 165.48 7.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.945 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.959 -179.957 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 120.937 0.398 . . . . 0.0 111.078 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.6 ptt85 -142.37 179.01 7.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.68 127.55 10.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.451 ' CD2' ' NE2' ' B' ' 53' ' ' HIS . 3.1 t-160 -62.06 83.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.454 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.442 ' O ' ' HB3' ' A' ' 58' ' ' GLU . 2.3 tp 179.79 -33.55 0.01 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.656 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.579 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 5.1 m -45.23 -80.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -35.02 -65.44 0.22 Allowed 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.527 ' CG1' ' HB ' ' B' ' 57' ' ' VAL . 4.3 t -52.86 -28.99 14.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.234 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.654 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.7 pt-20 -64.92 -48.75 73.02 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.424 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 53.1 p -64.54 -18.61 64.99 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.47 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -75.61 0.12 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.078 -179.709 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.6 mm? -59.97 -29.72 68.62 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.032 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.52 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 19.6 tt0 -62.89 -39.5 94.7 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.081 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.56 -15.55 58.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.754 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.41 ' CD1' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -85.64 -24.28 27.16 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.421 -179.547 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.442 ' CG ' ' HB3' ' B' ' 65' ' ' GLU . 0.1 OUTLIER -104.46 -21.9 13.39 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.78 -179.573 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.52 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 0.0 OUTLIER -84.43 2.01 42.71 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.264 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tp -114.09 -35.13 5.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 110.916 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -141.61 166.91 23.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.971 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.9 mt 58.95 55.73 4.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.053 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -129.19 -85.36 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.56 17.38 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.605 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.82 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.886 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.83 118.0 5.21 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.402 2.068 . . . . 0.0 112.339 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -161.86 162.27 29.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.808 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -144.54 133.21 22.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.915 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -177.64 -46.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.887 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 64.32 126.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.055 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.18 46.48 7.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.017 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 27.8 mtp -70.07 -41.18 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.749 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 12.5 mm -63.5 -51.33 71.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.834 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.405 HD22 ' CG2' ' B' ' 80' ' ' ILE . 0.9 OUTLIER -66.14 -29.03 69.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.854 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.9 -30.0 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.992 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.3 -21.6 24.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.05 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.83 102.72 15.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.901 0.382 . . . . 0.0 110.78 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.59 87.03 1.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.48 -17.98 11.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -71.4 -8.89 56.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.526 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 68.3 m-20 -73.1 -9.85 59.17 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.798 0.333 . . . . 0.0 110.995 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.425 HD11 HG22 ' A' ' 89' ' ' ILE . 7.4 mm -88.6 -53.0 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 94' ' ' THR . 1.6 tt0 -67.02 -20.7 65.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.911 178.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.25 -67.43 0.8 Allowed 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.409 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 1.1 tt -52.05 -23.74 5.69 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.02 0.438 . . . . 0.0 110.389 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 97' ' ' PHE . 8.1 tt -87.77 -38.43 15.77 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.532 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.405 ' CB ' ' O ' ' A' ' 90' ' ' GLU . 3.8 m -72.76 -10.89 60.32 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.87 -30.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.477 -0.868 . . . . 0.0 113.788 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.06 4.88 3.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' A' ' 93' ' ' LEU . 22.7 p90 40.3 70.57 0.23 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.575 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 13.8 p 42.79 46.42 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.863 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -67.62 0.39 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.913 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -112.69 176.7 4.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.921 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -154.17 130.0 10.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.814 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.9 p -153.64 147.24 14.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.086 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.28 106.84 10.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.963 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 40.9 mttp 61.68 152.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.836 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.93 86.99 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.832 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.055 -179.968 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.861 0.362 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 19.3 mtt85 -92.96 -29.16 16.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.883 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.51 127.87 10.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.259 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . 0.451 ' NE2' ' CD2' ' A' ' 53' ' ' HIS . 3.2 t-160 -62.04 83.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.53 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.446 ' O ' ' HB3' ' B' ' 58' ' ' GLU . 2.3 tp 179.84 -33.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.755 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.581 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 5.0 m -45.15 -80.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -34.91 -65.53 0.21 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.527 ' HB ' ' CG1' ' A' ' 57' ' ' VAL . 4.3 t -52.88 -28.94 14.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.165 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.635 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.7 pt-20 -64.98 -48.62 73.34 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 53.0 p -64.67 -18.55 65.08 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.486 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -75.54 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.067 -179.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.6 mm? -60.02 -29.71 68.68 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.948 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.525 ' O ' ' HB2' ' B' ' 66' ' ' GLN . 19.6 tt0 -62.79 -39.67 94.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.132 177.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.54 -15.48 58.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.716 178.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.416 ' CD1' HD12 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -85.68 -24.4 27.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.906 0.384 . . . . 0.0 111.339 -179.591 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.442 ' HB3' ' CG ' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -104.47 -21.83 13.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 0.525 ' HB2' ' O ' ' B' ' 62' ' ' GLU . 0.0 OUTLIER -84.53 2.2 42.27 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.298 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.409 HD21 ' CD2' ' B' ' 68' ' ' PHE . 6.0 tp -114.07 -35.18 5.14 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.833 0.349 . . . . 0.0 110.95 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . 0.409 ' CD2' HD21 ' B' ' 67' ' ' LEU . 46.7 m-85 -141.58 166.9 23.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.035 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 mp 58.95 55.56 4.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.093 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -128.98 -85.41 0.56 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.817 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.57 17.5 4.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.586 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.93 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.726 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.85 117.87 5.11 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.508 2.139 . . . . 0.0 112.349 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -161.31 160.39 29.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.826 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -119.44 -165.17 1.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.922 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.59 101.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.77 164.15 18.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.77 46.49 8.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.816 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 27.9 mtp -69.92 -41.28 74.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.719 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.405 ' CG2' HD22 ' A' ' 81' ' ' LEU . 12.4 mm -63.44 -51.35 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.17 -28.95 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.873 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.85 -30.18 62.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.972 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.24 -21.59 24.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.064 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.78 102.8 15.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.865 0.364 . . . . 0.0 110.744 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.69 87.12 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.01 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 mp -114.41 -18.19 11.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.269 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -71.36 -8.82 56.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.523 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 68.4 m-20 -73.02 -9.97 59.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.803 0.335 . . . . 0.0 111.04 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.41 HD11 HG22 ' B' ' 89' ' ' ILE . 7.4 mm -88.64 -53.03 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.422 ' N ' HG23 ' A' ' 89' ' ' ILE . 1.6 tt0 -66.96 -20.71 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.947 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.18 -67.44 0.79 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.529 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 1.1 tt -51.96 -23.91 5.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.979 0.419 . . . . 0.0 110.309 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 8.1 tt -87.72 -38.38 15.86 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.554 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.401 ' CB ' ' O ' ' B' ' 90' ' ' GLU . 3.8 m -72.73 -10.91 60.35 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.155 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.92 -30.23 1.66 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.433 -0.889 . . . . 0.0 113.645 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.09 4.97 3.01 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.406 ' CD2' ' O ' ' B' ' 97' ' ' PHE . 22.8 p90 40.26 70.48 0.24 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.878 0.37 . . . . 0.0 111.618 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 13.7 p 42.99 46.36 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.81 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -67.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.9 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -112.79 176.79 4.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -154.28 129.9 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.875 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.0 p -153.55 147.3 14.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.1 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.33 106.8 10.11 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.917 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.88 151.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.835 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.07 87.09 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.049 -179.958 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.728 0.299 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.52 166.02 11.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.851 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -115.52 85.49 2.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.159 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 179.05 57.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.634 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' A' ' 56' ' ' GLU . 0.3 OUTLIER -136.35 -51.49 0.7 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.873 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 54' ' ' LEU . 92.3 m 15.2 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.477 ' N ' ' O ' ' A' ' 54' ' ' LEU . 8.4 pt-20 -64.96 -55.95 16.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.632 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.547 ' CG1' ' HB ' ' B' ' 57' ' ' VAL . 4.6 t -59.6 -50.0 81.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-O 120.524 0.202 . . . . 0.0 111.454 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.761 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -53.11 -49.67 66.03 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.5 t -61.65 -21.43 64.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.589 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.454 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 0.7 OUTLIER -71.26 -73.17 0.19 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.311 -179.337 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.751 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -60.85 -27.1 67.85 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.129 -178.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 66' ' ' GLN . 1.8 tt0 -66.83 -38.81 87.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.376 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.402 ' CG ' ' CD2' ' A' ' 67' ' ' LEU . 45.2 ttp180 -83.54 -9.18 59.11 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.78 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -91.83 -27.41 17.98 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.03 0.443 . . . . 0.0 111.254 -179.079 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.814 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 1.4 tp10 -113.5 -48.3 2.95 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 8.4 tt0 -47.0 -43.82 19.71 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.402 ' CD2' ' CG ' ' A' ' 63' ' ' ARG . 3.3 pp -97.49 22.7 8.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.775 0.321 . . . . 0.0 111.038 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -135.65 96.3 3.42 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 110.649 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -154.97 158.7 39.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.619 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 31.3 mt -49.74 -28.18 5.8 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.826 0.345 . . . . 0.0 111.064 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 34.1 mm -67.32 -14.33 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.275 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.21 106.12 0.59 Allowed Pre-proline 0 C--N 1.332 -0.183 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.8 127.0 13.93 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.403 2.069 . . . . 0.0 112.336 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.27 -40.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.864 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -131.49 177.28 7.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -110.78 75.91 0.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.014 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.25 -39.66 62.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.77 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -146.69 93.77 2.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.868 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.16 -24.48 64.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.081 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.0 mm -63.31 -56.3 18.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.365 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' B' ' 81' ' ' LEU . 0.4 OUTLIER -82.89 -10.45 58.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.599 -179.657 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -88.19 -27.3 21.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.55 0.214 . . . . 0.0 111.263 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -16.25 12.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.536 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.57 -66.3 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.795 0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.59 -171.32 0.19 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.187 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -168.08 -43.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.786 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.873 ' O ' ' N ' ' A' ' 89' ' ' ILE . 38.1 mtt180 -107.89 -67.94 0.93 Allowed 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.826 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.411 ' N ' ' HB1' ' A' ' 91' ' ' ALA . 1.6 m-20 21.53 -59.39 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.873 ' N ' ' O ' ' A' ' 87' ' ' ARG . 19.9 mm -84.27 -58.24 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 87' ' ' ARG . 3.4 tm-20 -66.13 -12.06 53.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.347 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.416 ' O ' HG21 ' A' ' 94' ' ' THR . . . -87.22 -57.09 3.09 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.172 0.511 . . . . 0.0 110.054 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 0.1 OUTLIER -60.26 -21.28 61.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.869 178.884 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 mt -93.34 -35.43 13.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 12.8 t -75.61 -12.26 60.18 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.66 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.03 -29.44 1.81 Allowed Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.206 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.88 2.17 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.494 ' CD1' ' N ' ' A' ' 97' ' ' PHE . 0.1 OUTLIER 37.67 -93.1 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.167 179.638 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 20.1 t -76.79 138.24 20.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.779 0.323 . . . . 0.0 111.238 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -125.69 162.85 24.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.691 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.91 116.15 30.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.873 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -137.73 161.77 35.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.987 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.9 p -167.34 155.68 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -101.93 160.51 14.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.916 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.5 tttp 49.53 -174.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.075 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.57 -176.43 0.6 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.925 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.326 -0.845 . . . . 0.0 111.061 179.931 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 14.1 t . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.895 0.378 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 41.6 ttp85 -53.53 -57.32 11.12 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.264 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -116.58 85.49 2.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.361 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 179.02 57.45 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' B' ' 56' ' ' GLU . 0.3 OUTLIER -136.24 -51.47 0.71 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.9 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.449 ' C ' ' O ' ' B' ' 54' ' ' LEU . 92.2 m 15.16 -79.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' B' ' 54' ' ' LEU . 8.4 pt-20 -65.06 -55.85 16.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.601 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.547 ' HB ' ' CG1' ' A' ' 57' ' ' VAL . 4.5 t -59.59 -50.0 81.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-O 120.538 0.208 . . . . 0.0 111.461 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.751 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -53.06 -49.68 65.87 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.347 0.594 . . . . 0.0 109.522 179.073 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 12.4 t -61.8 -21.34 64.51 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.511 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.442 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 0.7 OUTLIER -71.38 -73.2 0.19 Allowed 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.417 -0.811 . . . . 0.0 112.267 -179.301 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.761 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -60.84 -26.91 67.69 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.207 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' B' ' 66' ' ' GLN . 1.8 tt0 -66.89 -38.82 86.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.317 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 -83.43 -9.35 59.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.808 179.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.513 HD11 ' O ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -91.82 -27.42 17.99 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.01 0.433 . . . . 0.0 111.271 -179.032 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.814 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.4 tp10 -113.53 -48.24 2.95 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . 0.446 ' HB2' ' O ' ' B' ' 62' ' ' GLU . 8.4 tt0 -46.99 -43.69 19.55 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 pp -97.56 22.71 8.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.724 0.297 . . . . 0.0 111.003 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -135.6 97.15 3.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.861 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -156.12 160.93 40.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.814 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 31.9 mt -51.12 -28.46 10.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 33.9 mm -67.34 -14.17 17.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.391 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.18 106.02 0.57 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.236 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.66 127.05 14.11 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.41 2.074 . . . . 0.0 112.387 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.16 -39.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.855 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.99 -176.32 3.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -78.52 -69.92 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.94 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.6 mt 68.82 -68.1 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -147.19 94.05 2.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.913 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.25 -24.51 64.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.09 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 39.3 mm -63.38 -56.17 18.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.315 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -82.97 -10.5 58.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.689 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -88.07 -27.33 22.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.685 0.279 . . . . 0.0 111.404 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.51 -16.18 12.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.621 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.5 -66.36 0.29 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.777 0.322 . . . . 0.0 111.012 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.7 -171.26 0.19 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.974 0.416 . . . . 0.0 111.026 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -168.15 -43.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.763 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.872 ' O ' ' N ' ' B' ' 89' ' ' ILE . 38.7 mtt180 -108.23 -67.9 0.94 Allowed 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.769 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . 0.415 ' N ' ' HB1' ' B' ' 91' ' ' ALA . 1.6 m-20 21.71 -59.54 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.872 ' N ' ' O ' ' B' ' 87' ' ' ARG . 20.4 mm -84.33 -58.22 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.478 ' N ' ' O ' ' B' ' 87' ' ' ARG . 3.4 tm-20 -66.0 -12.19 53.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.392 177.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . 0.415 ' HB1' ' N ' ' B' ' 88' ' ' ASP . . . -87.15 -57.03 3.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.138 0.494 . . . . 0.0 110.084 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 0.1 OUTLIER -60.15 -21.29 61.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.985 178.78 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 mt -93.32 -35.52 13.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.929 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.475 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 12.6 t -75.53 -12.26 60.19 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.752 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.04 -29.55 1.78 Allowed Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.722 -0.752 . . . . 0.0 113.137 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.78 2.16 11.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.504 ' N ' ' CD1' ' B' ' 97' ' ' PHE . 0.1 OUTLIER 37.78 -93.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.022 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 20.0 t -76.85 138.29 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 0.0 111.27 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -125.71 162.81 24.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.597 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.76 116.1 30.16 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.007 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -137.82 161.76 35.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.999 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.0 p -167.33 155.49 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.021 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -101.52 161.0 13.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.942 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.26 -173.35 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.291 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.81 -176.19 0.56 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.924 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.077 -179.972 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.973 0.416 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.1 tpp180 -113.87 -31.06 6.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.134 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -145.72 29.06 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.375 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 59.76 111.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.875 0.369 . . . . 0.0 110.889 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.551 ' O ' ' HB3' ' A' ' 58' ' ' GLU . 1.3 mt -119.15 -17.15 9.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.811 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.518 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 92.7 m -53.6 -84.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.29 -60.93 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' B' ' 54' ' ' LEU . 3.3 t -56.73 -39.33 63.06 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 120.918 0.389 . . . . 0.0 111.842 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HB3' ' O ' ' A' ' 54' ' ' LEU . 1.3 pt-20 -58.52 -55.06 39.96 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.478 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 31.4 t -63.53 -14.91 55.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.623 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.492 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 1.7 ttt180 -70.83 -74.03 0.16 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.493 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.581 ' CD2' ' HB2' ' B' ' 62' ' ' GLU . 0.1 OUTLIER -66.17 -20.02 66.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 117.772 -1.571 . . . . 0.0 109.702 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.592 ' HB2' ' CD2' ' B' ' 61' ' ' LEU . 11.0 tm-20 -64.4 -38.5 91.25 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 175.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -70.91 -29.35 65.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.863 177.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.43 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -67.47 -28.39 67.82 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.804 178.411 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -83.71 -31.28 26.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.249 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -29.08 68.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.28 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 68' ' ' PHE . 7.3 mt -84.06 -12.18 55.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.019 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.464 ' CE1' ' CG2' ' A' ' 71' ' ' ILE . 83.8 t80 65.54 95.22 0.06 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.873 0.368 . . . . 0.0 110.775 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.22 157.42 37.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.967 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 54.08 21.65 3.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.68 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.466 HD11 HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -120.96 -48.61 2.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.672 0.273 . . . . 0.0 110.827 179.715 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.432 ' N ' ' CG2' ' A' ' 71' ' ' ILE . 4.6 m-85 55.84 165.57 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.861 0.363 . . . . 0.0 111.262 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -78.19 126.07 7.53 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.642 2.228 . . . . 0.0 112.263 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.06 -30.58 11.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.993 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -91.98 166.71 12.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.949 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -107.82 -43.12 4.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 mp 63.49 140.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -109.84 -26.29 9.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.46 -29.1 61.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.073 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -65.14 -66.47 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.881 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.22 -19.35 54.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -81.23 -31.53 33.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.802 0.334 . . . . 0.0 111.027 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.4 ptm -92.6 -13.44 29.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.573 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.18 51.73 2.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 111.423 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.0 m 44.92 93.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.573 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -115.9 -28.67 6.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.166 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.34 -11.5 59.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.494 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.48 -10.43 59.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.718 0.294 . . . . 0.0 111.295 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.8 mm -89.58 -55.52 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.42 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.465 ' O ' ' HB ' ' A' ' 94' ' ' THR . 38.1 tt0 -66.32 -17.91 65.04 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.303 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.443 ' HA ' ' CG2' ' A' ' 94' ' ' THR . . . -88.24 -53.42 4.71 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.453 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 16.8 mt -58.76 -25.22 62.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.973 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.99 -39.38 11.7 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.067 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.465 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 10.7 t -70.94 -11.78 61.16 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.008 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.76 -34.76 1.23 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.958 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.402 ' C ' ' CD1' ' A' ' 97' ' ' PHE . 0.1 OUTLIER -98.36 -2.27 39.68 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.945 0.372 . . . . 0.0 111.914 -179.672 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.402 ' CD1' ' C ' ' A' ' 96' ' ' LEU . 3.4 p90 40.5 -125.94 0.45 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.277 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p -103.23 157.88 4.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.803 0.335 . . . . 0.0 111.229 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -104.73 101.42 11.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -70.18 102.63 2.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -154.68 151.83 29.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.8 m -110.1 -29.87 2.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -134.86 -179.79 5.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.93 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.06 136.05 33.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.846 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.92 153.19 18.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.925 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.078 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.779 0.323 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -135.62 49.36 2.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.985 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -145.09 28.81 1.21 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.206 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 59.93 111.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.867 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.558 ' O ' ' HB3' ' B' ' 58' ' ' GLU . 1.3 mt -119.21 -17.29 8.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.796 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.524 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 92.5 m -53.53 -84.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.32 -60.97 0.17 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.492 HG23 ' HA ' ' A' ' 54' ' ' LEU . 3.2 t -56.62 -39.33 62.16 Favored 'Isoleucine or valine' 0 C--O 1.25 1.08 0 CA-C-O 120.939 0.399 . . . . 0.0 111.93 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.558 ' HB3' ' O ' ' B' ' 54' ' ' LEU . 1.2 pt-20 -58.58 -55.06 39.89 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.485 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 31.2 t -63.49 -15.01 56.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.618 177.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.477 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 1.7 ttt180 -70.62 -74.19 0.15 Allowed 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.495 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.592 ' CD2' ' HB2' ' A' ' 62' ' ' GLU . 0.1 OUTLIER -66.15 -19.97 66.0 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 117.703 -1.599 . . . . 0.0 109.651 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.581 ' HB2' ' CD2' ' A' ' 61' ' ' LEU . 11.1 tm-20 -64.45 -38.5 91.23 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -70.92 -29.21 65.19 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.909 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.454 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.1 OUTLIER -67.54 -28.46 67.83 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.697 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -83.71 -31.35 26.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.093 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -29.09 68.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.262 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 7.3 mt -83.95 -12.18 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . 0.46 ' CE1' ' CG2' ' B' ' 71' ' ' ILE . 83.7 t80 65.58 95.14 0.06 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.801 0.334 . . . . 0.0 110.713 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.25 157.32 37.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 54.15 21.78 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.588 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . 0.465 HG22 HD11 ' B' ' 71' ' ' ILE . 0.0 OUTLIER -120.97 -48.64 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.611 0.243 . . . . 0.0 110.839 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . 0.436 ' N ' ' CG2' ' B' ' 71' ' ' ILE . 4.6 m-85 55.77 165.66 0.06 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.277 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.34 126.16 7.47 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.541 2.161 . . . . 0.0 112.268 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.05 -30.63 11.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.997 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -92.1 167.24 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -108.26 -42.96 4.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.926 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.2 mt 63.52 140.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.985 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -109.89 -26.28 9.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -29.21 61.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.016 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.6 mm -64.98 -66.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.973 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.3 -19.39 54.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.135 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -80.96 -31.69 34.77 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.823 0.344 . . . . 0.0 111.121 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 25.5 ptm -92.63 -13.38 29.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.568 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.25 51.75 2.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.781 0.324 . . . . 0.0 111.39 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 6.1 m 45.01 93.05 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.484 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tp -115.82 -28.79 6.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.044 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.36 -11.41 59.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.548 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.51 -10.43 59.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 0.0 111.309 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 17.2 mm -89.66 -55.59 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.454 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.468 ' O ' ' HB ' ' B' ' 94' ' ' THR . 38.2 tt0 -66.11 -18.05 65.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.278 177.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . 0.46 ' HA ' ' CG2' ' B' ' 94' ' ' THR . . . -88.23 -53.39 4.72 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.507 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 16.8 mt -58.77 -25.19 62.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.076 0.465 . . . . 0.0 110.083 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.93 -39.45 11.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.117 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 10.8 t -70.91 -11.88 61.22 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.942 179.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.67 -34.73 1.24 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.002 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.406 ' C ' ' CD1' ' B' ' 97' ' ' PHE . 0.1 OUTLIER -98.44 -2.09 39.85 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.758 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' B' ' 96' ' ' LEU . 3.4 p90 40.54 -125.93 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.304 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p -103.26 157.88 4.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -104.8 101.62 11.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.845 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -70.4 102.61 2.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.879 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -154.6 151.91 29.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 m -110.12 -29.94 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.103 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -134.83 -179.75 5.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.87 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.11 136.06 33.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.876 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.9 153.14 18.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.956 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.117 -179.961 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.821 0.343 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -122.35 77.77 1.44 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.445 ' O ' ' CG ' ' A' ' 53' ' ' HIS . . . -133.97 -117.29 0.19 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.905 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 52' ' ' ALA . 21.2 p80 43.58 30.06 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.753 0.311 . . . . 0.0 111.456 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.67 -32.59 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.404 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 1.7 m -75.59 -41.25 55.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.441 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.8 -40.97 63.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.928 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.563 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 2.8 t -71.89 -40.94 69.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 120.975 0.417 . . . . 0.0 110.839 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.752 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 24.5 pt-20 -62.63 -48.15 80.64 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.42 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 3.5 m -63.42 -22.67 67.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.309 177.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.563 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 2.7 mtt-85 -68.54 -71.68 0.21 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.671 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.0 mm? -61.37 -24.79 66.73 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.844 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.466 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.05 -37.02 86.21 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.69 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -31.13 68.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.866 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.48 -27.77 66.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.293 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.471 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 2.2 tm-20 -80.88 -31.58 35.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.473 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.02 -49.47 65.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.76 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 pp -63.0 -26.98 69.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.916 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.416 ' CZ ' ' HB2' ' B' ' 72' ' ' PHE . 2.1 m-85 64.68 160.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.934 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.94 88.22 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.795 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.473 ' O ' HG21 ' A' ' 71' ' ' ILE . 0.7 OUTLIER 51.57 51.67 16.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.473 HG21 ' O ' ' A' ' 70' ' ' LEU . 0.5 OUTLIER 41.82 31.35 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.897 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.419 ' HB2' ' CZ ' ' B' ' 68' ' ' PHE . 10.9 t80 68.31 100.96 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.62 -174.87 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.684 2.256 . . . . 0.0 112.169 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 66.5 -73.88 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.9 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 66.79 6.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.653 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.64 -46.28 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.028 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 tp 60.78 159.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.722 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -136.06 19.81 3.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.168 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -35.4 63.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.833 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.2 mp -64.01 -46.02 95.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.929 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.08 -27.88 54.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.895 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -27.84 62.55 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.81 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 13.5 ptp -95.64 -25.04 16.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.094 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.59 -50.45 9.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.7 p -178.93 130.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.977 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -175.89 -57.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.807 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -80.11 -28.45 38.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.789 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -72.75 -9.41 58.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.849 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.43 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 17.4 mm -89.66 -54.74 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.51 ' O ' ' HB ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -64.51 -21.11 66.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.197 177.799 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.407 ' O ' HG21 ' A' ' 94' ' ' THR . . . -86.42 -67.34 0.82 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.717 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 96' ' ' LEU . 71.6 mt -49.01 -26.61 2.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.063 0.459 . . . . 0.0 110.413 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 97' ' ' PHE . 1.0 OUTLIER -87.87 -44.01 11.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.978 179.672 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.51 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 9.8 t -67.79 -8.27 34.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.583 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.71 -29.73 1.65 Allowed Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.022 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.2 OUTLIER -100.43 -1.65 35.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.864 0.364 . . . . 0.0 111.96 -179.609 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.468 ' O ' ' CG1' ' A' ' 98' ' ' VAL . 73.9 t80 -65.85 -57.4 8.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.625 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.468 ' CG1' ' O ' ' A' ' 97' ' ' PHE . 9.9 p 50.68 164.05 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.139 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -141.95 109.66 5.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.993 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -111.83 90.46 3.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.836 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.59 174.29 2.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.852 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 5.7 m -117.44 126.99 74.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.079 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 60.13 -179.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -118.87 169.5 9.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.902 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -94.72 -40.45 9.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.065 -179.945 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.798 0.332 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.6 33.14 4.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.855 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' B' ' 53' ' ' HIS . . . -134.03 -117.21 0.19 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.953 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . 0.437 ' CG ' ' O ' ' B' ' 52' ' ' ALA . 21.3 p80 43.65 29.98 0.32 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.825 0.345 . . . . 0.0 111.535 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.65 -32.6 0.69 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 1.8 m -75.66 -41.23 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.75 -41.01 63.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.922 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.558 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 2.8 t -71.92 -40.83 68.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.083 0.468 . . . . 0.0 110.888 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.739 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.5 pt-20 -62.8 -47.98 81.11 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.418 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 3.5 m -63.52 -22.61 66.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.347 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.558 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 2.7 mtt-85 -68.47 -71.65 0.21 Allowed 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.791 -179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.0 mm? -61.27 -24.91 66.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 119.173 -1.011 . . . . 0.0 109.858 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.464 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -64.96 -37.2 86.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.713 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -31.13 69.03 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.033 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.37 -27.81 66.57 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.349 178.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.471 ' HB2' ' HB2' ' A' ' 65' ' ' GLU . 2.2 tm-20 -80.97 -31.48 34.78 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.414 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -49.58 64.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.795 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 pp -62.89 -27.0 69.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.939 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . 0.419 ' CZ ' ' HB2' ' A' ' 72' ' ' PHE . 2.1 m-85 64.64 160.53 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 10.2 tt -143.75 88.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.792 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.474 ' O ' HG21 ' B' ' 71' ' ' ILE . 0.7 OUTLIER 51.39 51.72 16.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.076 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . 0.474 HG21 ' O ' ' B' ' 70' ' ' LEU . 0.5 OUTLIER 41.83 31.34 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.869 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 68' ' ' PHE . 10.9 t80 68.32 100.78 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.062 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.45 -174.76 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.638 2.226 . . . . 0.0 112.236 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 66.36 -74.37 0.06 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.051 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.82 -69.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.944 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -66.86 0.24 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp 60.03 166.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.952 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -136.15 19.87 3.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.088 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -35.42 63.24 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.864 0.364 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 3.2 mp -64.06 -45.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.907 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.26 -27.89 53.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.777 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -27.79 62.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.814 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 13.5 ptp -95.64 -25.07 16.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.023 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.57 -50.42 10.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.974 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 13.7 p -178.91 130.12 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.828 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -175.91 -57.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.827 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -80.25 -28.43 38.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.758 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.65 -9.45 58.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.843 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.423 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 17.0 mm -89.56 -54.75 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.511 ' O ' ' HB ' ' B' ' 94' ' ' THR . 0.0 OUTLIER -64.48 -21.18 66.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.191 177.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . 0.402 ' O ' HG21 ' B' ' 94' ' ' THR . . . -86.48 -67.22 0.83 Allowed 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.733 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' B' ' 96' ' ' LEU . 71.5 mt -49.06 -26.65 2.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.13 0.491 . . . . 0.0 110.399 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' B' ' 97' ' ' PHE . 1.0 OUTLIER -87.77 -44.15 11.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.007 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 9.7 t -67.75 -8.2 33.62 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.549 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.72 -29.74 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.62 -0.8 . . . . 0.0 113.062 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 0.2 OUTLIER -100.45 -1.65 35.27 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.963 0.381 . . . . 0.0 111.936 -179.663 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.465 ' O ' ' CG1' ' B' ' 98' ' ' VAL . 74.4 t80 -65.82 -57.38 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.681 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . 0.465 ' CG1' ' O ' ' B' ' 97' ' ' PHE . 10.0 p 50.77 164.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.151 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -141.95 109.57 5.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.945 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -111.83 90.52 3.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.852 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.54 174.24 2.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.913 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.9 m -117.34 127.01 74.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.197 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 60.2 -179.18 0.1 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.905 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -119.04 169.48 9.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.929 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -94.55 -40.54 9.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.268 -0.872 . . . . 0.0 111.097 -179.912 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.783 0.325 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.37 -170.13 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.948 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.21 63.47 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.132 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.7 p-80 -134.24 147.25 50.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.828 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.427 ' CB ' ' HB3' ' A' ' 58' ' ' GLU . 0.5 OUTLIER -136.31 -53.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.575 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.606 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.1 m 21.5 -86.31 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -68.31 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.974 0.416 . . . . 0.0 111.324 -179.251 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.575 ' HA ' ' HB2' ' A' ' 60' ' ' ARG . 22.6 t -53.82 -27.97 16.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.726 -179.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.698 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -66.55 -46.8 74.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.189 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.02 -17.33 64.38 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.575 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -73.72 0.17 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.663 -179.805 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.684 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.1 mm? -62.35 -32.35 73.12 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.69 -179.364 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.456 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 3.4 tt0 -61.29 -36.31 79.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.199 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -81.09 -16.1 54.09 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.989 0.423 . . . . 0.0 110.023 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.519 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -79.12 -27.19 42.83 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.376 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.53 ' HG3' ' HG3' ' B' ' 65' ' ' GLU . 7.6 mm-40 -102.86 -21.6 13.99 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.125 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.61 -36.07 83.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.962 0.411 . . . . 0.0 110.171 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -83.27 -0.35 49.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.742 179.384 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 73.1 m-85 67.4 -96.65 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.067 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 47.21 28.0 0.92 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.696 0.284 . . . . 0.0 111.155 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.8 mt -154.7 -45.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.161 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.454 HD11 HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.43 46.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.093 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.48 ' O ' ' CG ' ' A' ' 72' ' ' PHE . 10.6 p90 -123.28 74.42 50.76 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.939 0.4 . . . . 0.0 110.866 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.54 16.62 1.88 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.818 2.345 . . . . 0.0 112.867 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.64 -58.32 2.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.839 0.352 . . . . 0.0 111.028 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 59.0 27.79 16.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -153.67 -53.09 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.793 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.6 pp -120.39 -173.45 2.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.808 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.538 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 3.0 m-20 -137.49 93.96 2.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.763 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.5 -38.88 88.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.881 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 42.5 mm -73.51 -43.26 55.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' B' ' 81' ' ' LEU . 1.7 mm? -74.18 -22.29 59.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.252 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -90.35 -27.71 19.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.872 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.84 -23.91 25.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.062 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.423 ' CB ' ' HG ' ' B' ' 81' ' ' LEU . 12.8 m-20 -103.92 104.15 14.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.04 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.3 m 60.85 113.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.972 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tp -178.45 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.027 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.69 -25.04 17.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.046 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.47 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -70.24 -10.16 58.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.301 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 17.1 mm -90.73 -56.79 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.55 ' O ' ' HB ' ' A' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.22 64.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.22 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.402 ' O ' HG21 ' A' ' 94' ' ' THR . . . -86.96 -56.11 3.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.252 179.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 3.1 mm? -51.74 -26.27 9.14 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 0.3 OUTLIER -90.46 -38.51 13.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 90' ' ' GLU . 2.1 t -67.33 -11.22 57.07 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.1 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.25 -28.6 1.62 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.486 -0.864 . . . . 0.0 113.052 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.93 2.4 35.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . 0.432 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 29.3 p90 -41.05 137.64 1.24 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.556 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.2 p -83.62 145.44 8.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.096 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -145.37 99.02 3.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.955 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -147.51 -46.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.908 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -107.96 128.71 54.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 35.5 m -119.29 -39.29 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.199 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -106.86 37.49 2.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -158.24 163.05 37.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.95 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -106.37 133.45 51.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.873 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.107 179.963 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 120.808 0.337 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.82 177.24 7.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.844 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.58 63.6 1.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.265 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -134.39 147.11 50.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.43 ' CB ' ' HB3' ' B' ' 58' ' ' GLU . 0.5 OUTLIER -136.28 -52.83 0.73 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.671 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.604 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 97.3 m 21.28 -86.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 179.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.29 -68.24 0.3 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.889 0.376 . . . . 0.0 111.312 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.584 ' HA ' ' HB2' ' B' ' 60' ' ' ARG . 23.1 t -53.86 -28.01 16.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.687 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.684 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -66.42 -46.84 75.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.135 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.92 -17.42 64.45 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.584 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -73.75 0.17 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.737 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.698 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.1 mm? -62.17 -32.36 72.97 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.49 -0.884 . . . . 0.0 109.851 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.452 ' CB ' ' O ' ' B' ' 58' ' ' GLU . 3.5 tt0 -61.39 -36.23 79.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.249 177.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -81.08 -16.12 54.05 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.047 0.451 . . . . 0.0 110.014 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.538 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -79.17 -27.12 42.64 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.336 179.941 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.53 ' HG3' ' HG3' ' A' ' 65' ' ' GLU . 7.6 mm-40 -102.84 -21.66 13.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.109 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.63 -36.16 83.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.944 0.402 . . . . 0.0 110.065 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.04 -0.45 49.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.799 179.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 67.41 -96.42 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.107 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 tt 47.06 27.98 0.84 Allowed 'General case' 0 CA--C 1.528 0.103 0 CA-C-O 120.71 0.291 . . . . 0.0 111.272 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 98.1 mt -154.81 -45.8 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.152 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . 0.471 HG22 HD11 ' B' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.083 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . 0.473 ' CG ' ' O ' ' B' ' 72' ' ' PHE . 10.6 p90 -123.25 74.46 50.56 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-O 120.963 0.411 . . . . 0.0 110.851 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -87.53 16.54 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.905 2.403 . . . . 0.0 112.898 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.68 -58.15 2.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.841 0.353 . . . . 0.0 110.941 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.07 29.91 19.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 -158.4 -50.61 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.776 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -120.15 -177.82 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.822 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . 0.535 ' HB3' ' HB2' ' B' ' 81' ' ' LEU . 3.0 m-20 -135.61 93.28 2.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.631 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.37 -38.86 88.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.928 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 42.5 mm -73.56 -43.2 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.55 ' HA ' HD11 ' A' ' 81' ' ' LEU . 1.7 mm? -74.17 -22.29 59.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.264 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -90.37 -27.68 19.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.867 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.98 25.08 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.998 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . 0.429 ' CB ' ' HG ' ' A' ' 81' ' ' LEU . 12.7 m-20 -103.86 104.26 14.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.959 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 58.4 m 60.71 112.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.866 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -177.45 -39.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.952 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.23 -24.93 17.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.134 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . 0.486 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.0 OUTLIER -70.19 -10.15 57.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.391 179.875 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 17.1 mm -90.8 -56.73 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.19 64.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.263 177.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.05 -56.09 3.53 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.201 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.486 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 3.1 mm? -51.72 -26.15 8.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 0.3 OUTLIER -90.6 -38.58 13.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.676 179.408 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.547 ' HB ' ' O ' ' B' ' 90' ' ' GLU . 2.1 t -67.2 -11.34 57.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.075 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.31 -28.44 1.64 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.552 -0.833 . . . . 0.0 113.053 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.0 2.37 34.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . 0.432 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 29.2 p90 -41.14 137.77 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.561 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.3 p -83.71 145.43 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -145.41 99.02 3.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.922 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -147.39 -47.02 0.17 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -107.83 128.68 54.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 35.5 m -119.26 -39.39 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.222 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -106.74 37.62 2.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.864 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.55 162.9 37.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.913 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -106.28 133.41 51.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.896 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.163 179.99 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.865 0.365 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.88 -177.13 3.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.814 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 66.13 131.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.86 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' B' ' 53' ' ' HIS . 2.5 m-70 -92.52 127.4 38.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.165 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.49 ' O ' ' C ' ' A' ' 55' ' ' THR . 6.3 tp -174.11 -90.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.003 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.585 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.6 m 3.02 -100.29 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -35.97 -69.92 0.1 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.462 HG23 ' HA ' ' B' ' 54' ' ' LEU . 5.1 t -46.66 -29.93 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.553 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.611 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.4 pt-20 -66.88 -48.25 69.33 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 2.1 m -65.86 -14.63 61.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.201 177.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.03 -75.95 0.19 Allowed 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.835 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.684 ' HB2' ' HB2' ' B' ' 61' ' ' LEU . 3.9 mm? -60.36 -25.3 65.75 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.803 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.495 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 11.4 tt0 -73.13 -37.08 66.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.0 mmt180 -58.82 -39.99 82.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.488 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.522 HD22 ' HA ' ' A' ' 61' ' ' LEU . 1.2 pp -78.46 -23.28 46.6 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.238 178.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.495 ' HB3' ' HA ' ' A' ' 62' ' ' GLU . 1.2 tp10 -65.68 -34.56 78.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.475 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -28.18 62.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.422 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.454 ' C ' ' CG ' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -92.68 -0.36 57.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.256 179.849 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.454 ' CG ' ' C ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER 47.13 -88.81 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.592 179.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 67' ' ' LEU . 3.6 tp 64.26 24.69 13.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.684 0.278 . . . . 0.0 110.894 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.5 mt -148.79 -48.55 0.15 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.8 mp -82.82 -34.22 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.185 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.83 92.52 4.4 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.98 -170.37 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.471 2.114 . . . . 0.0 112.34 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -145.82 85.07 1.68 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.251 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.13 164.49 14.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.585 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.56 49.61 1.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -179.73 148.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.009 179.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.501 ' HB2' ' HB2' ' A' ' 81' ' ' LEU . 1.2 p30 -86.97 79.8 8.63 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -50.65 -28.01 8.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.25 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 21.0 mt -76.7 -60.3 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.953 0.406 . . . . 0.0 110.732 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.501 ' HB2' ' HB2' ' A' ' 78' ' ' ASP . 2.3 mm? -54.68 -19.56 6.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.764 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.55 -25.11 13.33 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.1 mmm -98.94 -2.01 38.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.51 87.98 2.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.389 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.06 -156.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 63.26 29.63 15.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.835 0.35 . . . . 0.0 110.936 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.15 -42.33 1.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.608 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.499 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 17.4 t70 -70.71 -9.54 57.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.051 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.441 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 2.6 mp -88.66 -56.09 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -19.97 65.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.259 177.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.9 -63.74 1.27 Allowed 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.65 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.499 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 1.2 tt -51.54 -24.41 5.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.947 0.403 . . . . 0.0 110.431 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 3.8 mm? -90.12 -40.99 11.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.485 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.79 -13.63 59.81 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.167 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.28 -50.23 0.31 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.228 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.4 ' N ' ' CD2' ' A' ' 96' ' ' LEU . 2.6 mm? -98.12 -2.48 39.91 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.24 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.92 32.96 0.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.834 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 18.3 t -76.59 130.84 35.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.931 0.396 . . . . 0.0 111.266 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.6 mm100 -65.7 -62.63 1.4 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.071 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -137.78 -44.82 0.53 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.128 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.1 t30 69.54 107.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.904 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.0 p -129.41 113.1 26.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.048 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -143.11 -53.9 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.951 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.5 ptpp? -173.71 -43.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.898 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -94.55 153.77 17.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.921 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.051 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.778 0.323 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.18 -165.07 2.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.861 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . 69.05 131.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.851 0.358 . . . . 0.0 111.102 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 53' ' ' HIS . 2.5 m-70 -92.74 127.43 38.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.075 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.494 ' O ' ' C ' ' B' ' 55' ' ' THR . 6.3 tp -174.08 -90.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.031 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.59 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 98.8 m 3.17 -100.37 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -35.7 -70.15 0.09 Allowed 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' VAL . . . . . 0.479 HG23 ' HA ' ' A' ' 54' ' ' LEU . 5.3 t -46.68 -30.06 1.26 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.571 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.404 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.4 pt-20 -66.71 -48.34 69.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.472 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 2.1 m -65.73 -14.62 61.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.288 177.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.402 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -77.02 -75.97 0.19 Allowed 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.798 -179.603 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . 0.684 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 3.9 mm? -60.39 -25.31 65.81 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 119.74 -0.784 . . . . 0.0 109.793 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.489 ' HA ' ' HB3' ' B' ' 65' ' ' GLU . 11.3 tt0 -73.05 -37.18 66.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.472 ' HB2' ' O ' ' B' ' 59' ' ' SER . 1.9 mmt180 -58.89 -39.9 82.8 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.542 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.504 HD22 ' HA ' ' B' ' 61' ' ' LEU . 1.2 pp -78.44 -23.33 46.66 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.272 178.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . 0.489 ' HB3' ' HA ' ' B' ' 62' ' ' GLU . 1.1 tp10 -65.64 -34.58 78.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.479 178.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.57 -28.18 62.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.402 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.444 ' C ' ' CG ' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -92.65 -0.23 57.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.266 179.803 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 46.96 -88.79 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.504 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.442 ' N ' ' O ' ' B' ' 67' ' ' LEU . 0.2 OUTLIER 64.19 24.81 13.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.694 0.283 . . . . 0.0 110.943 -179.849 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 mt -148.86 -48.65 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.91 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 3.8 mp -82.86 -34.0 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.26 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.95 92.47 4.46 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -68.9 -170.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.46 2.107 . . . . 0.0 112.411 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -146.76 81.04 1.55 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.543 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' B' ' 77' ' ' LEU . 3.6 mt-10 -119.96 12.79 12.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.638 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 66.12 -73.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.752 0.311 . . . . 0.0 110.889 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' B' ' 75' ' ' GLU . 0.5 OUTLIER -49.48 149.4 2.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.902 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' ASP . . . . . 0.501 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 1.4 p30 -93.42 79.52 4.39 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.096 0.474 . . . . 0.0 111.464 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -51.33 -27.79 10.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.062 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 20.9 mt -76.69 -60.24 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.95 0.405 . . . . 0.0 110.755 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.501 ' HB2' ' HB2' ' B' ' 78' ' ' ASP . 2.3 mm? -54.75 -19.59 6.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.701 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.41 -25.22 13.35 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 8.2 mmm -98.87 -2.04 38.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -178.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.42 88.02 2.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.03 -156.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.053 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . 0.427 ' N ' ' CD1' ' B' ' 86' ' ' LEU . 5.9 mp 63.28 29.54 15.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.904 0.383 . . . . 0.0 110.972 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.25 -42.48 1.51 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.732 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 17.4 t70 -70.65 -9.46 57.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.052 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.445 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 2.6 mp -88.67 -55.98 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.35 -20.04 65.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.338 177.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.93 -63.72 1.27 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.614 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 1.2 tt -51.52 -24.38 5.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.918 0.389 . . . . 0.0 110.433 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' B' ' 89' ' ' ILE . 3.9 mm? -90.21 -40.96 11.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.403 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.84 -13.53 59.71 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.223 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.32 -50.2 0.31 Allowed Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.457 -0.878 . . . . 0.0 113.182 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -98.18 -2.62 39.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.95 33.1 0.13 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.788 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 18.6 t -76.69 130.87 35.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.227 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 8.6 mm100 -65.72 -62.71 1.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.956 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -137.84 -44.81 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 2.1 t30 69.55 107.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.829 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 11.0 p -129.33 113.0 26.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.106 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -143.11 -53.83 0.39 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.8 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -173.75 -44.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -94.4 153.76 17.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.865 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.173 -0.918 . . . . 0.0 111.194 179.92 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.931 0.396 . . . . 0.0 111.313 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.75 -31.29 6.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.817 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.64 HD23 HG13 ' B' ' 57' ' ' VAL . 9.0 mt 64.47 -80.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.239 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.502 ' C ' ' O ' ' A' ' 54' ' ' LEU . 97.2 m 6.54 -90.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.46 -70.05 0.12 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.639 HG13 HD23 ' B' ' 54' ' ' LEU . 4.6 t -50.18 -25.08 2.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.577 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.742 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.39 73.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.62 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.574 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 20.0 m -69.49 -15.72 63.31 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -73.38 -74.03 0.19 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.475 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.4 mm? -62.06 -28.29 69.49 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 119.362 -0.935 . . . . 0.0 109.992 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.536 ' HB2' HD12 ' B' ' 61' ' ' LEU . 2.6 tt0 -65.08 -39.04 92.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.031 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.2 ttm105 -66.73 -28.18 68.21 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.849 HD11 ' CD2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -72.77 -27.42 61.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.748 178.533 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.783 ' O ' HD11 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -78.01 -32.96 51.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.015 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.75 -22.93 45.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.6 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.826 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.9 tm? -77.56 -29.52 52.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.884 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.856 ' CD1' HD12 ' A' ' 71' ' ' ILE . 0.1 OUTLIER 72.34 -165.57 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.778 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.466 ' CB ' ' O ' ' A' ' 68' ' ' PHE . 8.0 tp 86.88 -33.05 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.85 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.849 ' CD2' HD11 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -113.68 -16.39 12.33 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.474 0.178 . . . . 0.0 111.225 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.856 HD12 ' CD1' ' A' ' 68' ' ' PHE . 60.8 mt -51.64 -37.18 19.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.714 0.293 . . . . 0.0 111.271 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.438 ' CG ' ' HD2' ' A' ' 73' ' ' PRO . 1.4 t80 -109.03 142.24 25.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.815 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.438 ' HD2' ' CG ' ' A' ' 72' ' ' PHE . 51.2 Cg_endo -69.15 -28.8 27.74 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.458 2.106 . . . . 0.0 112.291 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -112.13 -179.48 3.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.739 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -98.06 -49.29 4.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.056 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.07 146.47 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.023 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.688 HD12 HG13 ' A' ' 80' ' ' ILE . 0.8 OUTLIER -103.13 -80.05 0.52 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.738 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 71.85 -57.58 0.61 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.298 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.39 6.16 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.684 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.688 HG13 HD12 ' A' ' 77' ' ' LEU . 58.0 mt -61.16 -29.97 46.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 111.144 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.787 ' O ' HD12 ' A' ' 86' ' ' LEU . 1.4 mt -73.2 -26.7 61.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.049 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.8 -19.63 22.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.5 mtm -93.01 -22.88 18.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.039 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -86.8 -60.72 1.91 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.65 120.41 0.91 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.882 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.787 HD12 ' O ' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -169.76 -41.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.018 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -74.08 -38.74 63.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.029 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.782 ' O ' HD23 ' A' ' 92' ' ' LEU . 5.1 m-20 -70.36 -11.41 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.698 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.1 mp -91.55 -54.95 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.24 -19.63 64.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.33 4.26 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.158 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.782 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.3 mm? -53.08 -26.18 15.33 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.081 0.467 . . . . 0.0 109.841 178.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.441 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 0.5 OUTLIER -92.55 -38.05 12.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.165 179.206 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.5 m -63.3 -15.05 56.08 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.012 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.7 -28.85 1.11 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.41 -0.9 . . . . 0.0 113.395 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.31 5.41 34.54 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 21.9 p90 -36.69 139.56 0.18 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.688 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 28.0 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.082 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.828 0.347 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.64 -31.29 6.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.858 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.639 HD23 HG13 ' A' ' 57' ' ' VAL . 9.0 mt 64.32 -80.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.215 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.499 ' C ' ' O ' ' B' ' 54' ' ' LEU . 97.6 m 6.39 -90.47 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -70.17 0.11 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.948 0.404 . . . . 0.0 112.083 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.64 HG13 HD23 ' A' ' 54' ' ' LEU . 4.6 t -50.15 -25.0 2.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.562 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.732 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.43 73.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.612 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.578 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 19.9 m -69.45 -15.68 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.472 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.3 OUTLIER -73.46 -74.0 0.19 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.505 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.742 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.4 mm? -62.02 -28.34 69.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.841 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.53 ' HB2' HD12 ' A' ' 61' ' ' LEU . 2.6 tt0 -65.15 -38.97 92.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 63' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.1 ttm105 -66.82 -28.03 68.03 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.847 HD11 ' CD2' ' B' ' 70' ' ' LEU . 0.1 OUTLIER -72.96 -27.49 61.85 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.567 178.644 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.785 ' O ' HD11 ' B' ' 71' ' ' ILE . 0.1 OUTLIER -77.96 -33.02 51.73 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.027 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.67 -23.01 45.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.596 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.838 HD13 ' O ' ' B' ' 67' ' ' LEU . 2.9 tm? -77.47 -29.48 52.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.987 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.858 ' CD1' HD12 ' B' ' 71' ' ' ILE . 0.1 OUTLIER 72.24 -165.46 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.826 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' B' ' 68' ' ' PHE . 0.3 OUTLIER 86.58 -33.01 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.891 179.67 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.847 ' CD2' HD11 ' B' ' 64' ' ' LEU . 0.1 OUTLIER -113.49 -16.37 12.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.525 0.203 . . . . 0.0 111.254 -179.779 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.858 HD12 ' CD1' ' B' ' 68' ' ' PHE . 60.9 mt -51.66 -37.1 19.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.767 0.318 . . . . 0.0 111.354 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 72' ' ' PHE . . . . . 0.441 ' CG ' ' HD2' ' B' ' 73' ' ' PRO . 1.4 t80 -109.04 142.1 24.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.774 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' B' ' 72' ' ' PHE . 51.3 Cg_endo -69.14 -28.75 27.84 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.447 2.098 . . . . 0.0 112.361 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -111.84 179.77 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.875 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -93.45 -60.33 1.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.988 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.49 155.72 26.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.856 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.765 HD22 HD12 ' B' ' 80' ' ' ILE . 1.9 mt -109.21 -79.04 0.59 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.785 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 72.85 -57.87 0.62 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.399 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.44 6.12 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.768 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.765 HD12 HD22 ' B' ' 77' ' ' LEU . 58.1 mt -61.1 -30.08 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.057 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 81' ' ' LEU . 1.4 mt -73.11 -26.82 61.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.065 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.68 -19.65 22.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.212 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 9.6 mtm -93.05 -22.84 18.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 0.0 111.053 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' ASP . . . . . 0.405 ' HB3' ' CD1' ' A' ' 81' ' ' LEU . 1.7 m-20 -86.79 -60.76 1.9 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.901 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.68 120.53 0.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.98 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.545 ' CA ' HD13 ' B' ' 89' ' ' ILE . 0.5 OUTLIER -169.78 -42.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -73.71 -38.72 64.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.982 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.803 ' O ' HD23 ' B' ' 92' ' ' LEU . 5.1 m-20 -70.38 -11.47 60.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.34 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.711 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.1 mp -91.52 -55.09 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.21 -19.55 64.62 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.136 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.28 4.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.255 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.803 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.3 mm? -53.12 -26.1 15.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.047 0.451 . . . . 0.0 109.833 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -92.56 -38.12 12.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.087 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -63.21 -15.23 56.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.98 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.55 -28.96 1.12 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.412 -0.899 . . . . 0.0 113.37 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.534 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.5 OUTLIER -104.23 5.33 34.7 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.327 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.445 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 21.5 p90 -36.73 139.51 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.68 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 27.2 t . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.103 179.965 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.439 ' HB1' ' NE2' ' B' ' 53' ' ' HIS . . . . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.683 0.278 . . . . 0.0 111.049 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.444 ' NE2' ' HB1' ' B' ' 52' ' ' ALA . 39.8 m80 65.23 153.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.438 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.624 HD12 ' N ' ' A' ' 54' ' ' LEU . 4.6 mp 64.26 -137.52 0.29 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.705 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.435 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.7 m 27.94 -84.94 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 54' ' ' LEU . 4.1 mm-40 -66.41 -64.43 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.138 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.623 ' HB ' HG11 ' B' ' 57' ' ' VAL . 20.6 t -56.84 -44.11 81.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.193 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.699 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 4.7 pt-20 -55.4 -48.68 73.99 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-O 121.451 0.643 . . . . 0.0 109.514 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.436 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 1.2 m -64.38 -19.06 65.25 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.654 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.04 -73.85 0.19 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.228 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.694 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.5 mm? -62.97 -25.36 68.33 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.09 -179.099 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.561 ' HB2' HD12 ' B' ' 61' ' ' LEU . 2.5 tt0 -69.33 -38.3 78.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.1 OUTLIER -65.38 -30.36 71.17 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 177.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.451 178.32 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.403 ' HA ' ' HG3' ' B' ' 65' ' ' GLU . 0.0 OUTLIER -73.53 -32.15 64.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.163 178.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.96 -23.12 44.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.843 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.99 -22.84 33.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 63.76 175.65 0.17 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.967 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tp -129.71 -66.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.973 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.5 mt -124.6 47.25 2.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.18 -58.05 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.086 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -113.73 101.72 54.08 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.82 -51.2 1.36 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.391 2.06 . . . . 0.0 112.348 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.57 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.804 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -175.99 118.22 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.002 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -159.08 -63.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 74.59 5.66 4.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -130.94 -34.04 1.51 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.659 0.266 . . . . 0.0 111.354 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -28.02 61.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.333 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.67 -65.03 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.005 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.457 ' H ' HD23 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -62.67 -18.75 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.07 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -80.72 -31.83 35.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 mtm -89.1 -18.2 27.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.98 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -94.25 -40.29 10.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.91 0.386 . . . . 0.0 110.847 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.03 139.07 30.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.45 18.16 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.112 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.78 23.25 11.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.128 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.491 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.9 OUTLIER -73.83 -11.29 60.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.896 0.379 . . . . 0.0 110.936 179.442 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.711 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.4 mp -93.31 -50.93 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.83 -21.58 66.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.459 -0.791 . . . . 0.0 108.931 177.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.02 -48.97 7.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.195 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.491 HD12 ' O ' ' A' ' 88' ' ' ASP . 12.7 mt -56.86 -25.27 56.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.202 0.525 . . . . 0.0 109.778 178.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.12 -36.68 11.96 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.225 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.0 m -65.82 -15.41 62.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.933 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.37 -36.36 0.65 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.218 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.452 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -97.94 -2.28 40.93 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.4 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 18.2 p90 38.78 75.84 0.07 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.806 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 42.1 t . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.935 -179.974 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 52' ' ' ALA . . . . . 0.444 ' HB1' ' NE2' ' A' ' 53' ' ' HIS . . . . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.713 0.292 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.439 ' NE2' ' HB1' ' A' ' 52' ' ' ALA . 40.0 m80 65.38 153.66 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.027 0.442 . . . . 0.0 111.238 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.622 ' N ' HD12 ' B' ' 54' ' ' LEU . 4.5 mp 64.13 -137.5 0.3 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.768 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.4 m 27.88 -84.83 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' B' ' 54' ' ' LEU . 4.1 mm-40 -66.45 -64.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.794 0.331 . . . . 0.0 111.192 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.623 HG11 ' HB ' ' A' ' 57' ' ' VAL . 20.6 t -56.86 -44.12 81.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.119 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.694 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 4.7 pt-20 -55.54 -48.49 74.64 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.336 0.589 . . . . 0.0 109.477 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 1.2 m -64.5 -19.06 65.36 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.099 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.24 -73.66 0.2 Allowed 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.203 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.5 mm? -63.14 -25.16 68.22 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.126 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.531 ' HB2' HD12 ' A' ' 61' ' ' LEU . 2.4 tt0 -69.52 -38.2 77.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 176.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -30.42 71.22 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.395 178.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.403 ' HG3' ' HA ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -73.5 -32.21 64.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.129 179.037 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -23.2 44.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.834 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -22.86 33.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.145 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 63.81 175.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.911 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 mp -129.59 -67.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 42.7 mt -124.01 47.36 2.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.104 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.27 -58.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' PHE . . . . . 0.405 ' HA ' ' HD2' ' B' ' 73' ' ' PRO . 7.5 m-85 -113.66 101.79 54.12 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 73' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' B' ' 72' ' ' PHE . 36.7 Cg_endo -65.85 -51.19 1.35 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.325 2.017 . . . . 0.0 112.462 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.66 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.114 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -152.1 -174.64 4.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.924 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 68.93 114.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.069 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.0 mp -101.64 47.62 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.645 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -127.25 -34.03 2.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.18 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -28.06 62.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.195 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.61 -65.05 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.988 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.467 ' H ' HD23 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -62.65 -18.8 63.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.04 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -80.7 -31.88 36.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 0.0 110.742 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 1.2 mtm -88.98 -18.34 27.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.93 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -94.28 -40.18 10.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.774 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.12 139.03 30.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.882 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.6 tp -94.51 18.16 11.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.91 23.2 11.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.128 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.473 ' O ' HD12 ' B' ' 92' ' ' LEU . 0.9 OUTLIER -73.92 -11.25 60.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 0.0 110.893 179.52 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.701 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.4 mp -93.11 -51.06 11.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.02 -21.34 66.83 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.809 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.07 -49.03 7.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.211 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.473 HD12 ' O ' ' B' ' 88' ' ' ASP . 12.7 mt -56.85 -25.27 56.03 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.104 0.478 . . . . 0.0 109.726 178.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.05 -36.76 11.97 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.154 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.9 m -65.87 -15.45 62.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.814 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.33 -36.46 0.65 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.27 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.445 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.4 OUTLIER -97.96 -2.33 40.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.997 0.399 . . . . 0.0 112.049 -179.363 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.403 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 18.0 p90 38.8 75.79 0.07 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.749 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.043 179.952 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.108 0 CA-C-O 120.922 0.392 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 51.63 -97.74 0.06 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.929 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.626 ' HG ' HG13 ' B' ' 57' ' ' VAL . 0.4 OUTLIER 66.14 -73.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.601 0.238 . . . . 0.0 111.335 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.449 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 55.7 m 9.34 -76.54 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.6 pt-20 -63.27 -60.56 3.24 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.67 ' HB ' HG11 ' B' ' 57' ' ' VAL . 17.2 t -59.12 -48.58 86.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.651 -179.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.724 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.02 -46.41 68.4 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 121.292 0.568 . . . . 0.0 109.555 179.035 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.7 -21.42 66.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.544 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.45 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.3 -71.59 0.25 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.381 -179.387 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -62.1 -30.68 71.18 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.812 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.453 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 45.7 tt0 -63.29 -37.56 87.73 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.89 -29.93 69.15 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.8 -27.78 64.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 121.484 0.659 . . . . 0.0 109.516 178.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -78.56 -31.77 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.502 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.67 -33.43 66.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.764 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 3.9 mp -63.08 -26.05 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.471 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 3.2 m-85 68.71 -61.0 0.43 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.442 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 70.71 -65.38 0.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.768 0.318 . . . . 0.0 110.667 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 30.9 mt -137.41 53.9 1.85 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.606 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.895 HG23 HG23 ' B' ' 71' ' ' ILE . 36.1 mm -127.14 -45.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.187 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.431 ' O ' ' CD2' ' A' ' 72' ' ' PHE . 37.6 p90 -48.0 105.5 0.5 Allowed Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.213 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -79.15 132.65 10.49 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.136 . . . . 0.0 112.289 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.0 -46.86 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.61 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -165.67 65.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.043 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.56 -81.16 0.36 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.7 mt -96.93 112.09 24.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.647 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.491 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 4.0 t0 -178.94 89.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.98 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.49 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 13.6 ptt? -53.09 -45.26 68.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.684 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.896 HG13 HD11 ' B' ' 81' ' ' LEU . 45.1 mm -65.07 -49.57 78.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.775 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.925 HD11 HG13 ' B' ' 80' ' ' ILE . 1.2 mm? -64.84 -21.29 66.76 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 9.0 pttp -93.54 -24.71 17.87 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' MET . . . . . 0.5 ' HE3' HD13 ' A' ' 80' ' ' ILE . 18.5 ptp -93.91 -15.26 25.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.82 -65.37 0.31 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.75 0.309 . . . . 0.0 110.935 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.621 ' O ' HD12 ' A' ' 86' ' ' LEU . 42.9 m 65.04 65.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.651 HD23 HG13 ' B' ' 89' ' ' ILE . 1.5 mp -150.15 32.67 0.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.703 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -112.99 -35.91 5.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.994 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.635 ' O ' HD13 ' A' ' 92' ' ' LEU . 2.3 m-20 -71.75 -13.47 61.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 111.031 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.786 HG13 HD23 ' B' ' 86' ' ' LEU . 26.2 mm -86.16 -57.37 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.551 ' O ' ' HB ' ' A' ' 94' ' ' THR . 30.2 tt0 -64.13 -18.84 64.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.303 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.703 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -83.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.525 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.635 HD13 ' O ' ' A' ' 88' ' ' ASP . 6.5 mp -49.31 -29.22 5.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.024 0.44 . . . . 0.0 110.448 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.476 ' HG ' ' HA ' ' B' ' 90' ' ' GLU . 4.3 mm? -85.24 -38.97 18.31 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.5 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.703 HG22 ' HA ' ' A' ' 91' ' ' ALA . 8.7 t -73.16 -7.59 52.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.957 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -113.05 -32.53 2.19 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 96' ' ' LEU . 2.8 mm? -98.31 -7.42 29.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.975 0.388 . . . . 0.0 111.843 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 44.8 p90 31.92 42.03 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.887 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.4 p . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.284 -179.682 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.854 0.359 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.4 ' O ' ' N ' ' B' ' 55' ' ' THR . 5.5 t-80 51.79 -97.75 0.06 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.896 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.606 ' HG ' HG13 ' A' ' 57' ' ' VAL . 0.4 OUTLIER 66.18 -73.94 0.07 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.664 0.268 . . . . 0.0 111.317 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.458 ' O ' ' HG3' ' B' ' 58' ' ' GLU . 57.3 m 9.45 -76.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.6 pt-20 -63.31 -60.47 3.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.67 HG11 ' HB ' ' A' ' 57' ' ' VAL . 17.1 t -59.05 -48.63 86.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 122.157 -0.339 . . . . 0.0 111.665 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.741 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.08 -46.37 68.58 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.345 0.593 . . . . 0.0 109.583 179.11 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.66 -21.52 66.75 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.536 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.432 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.15 -71.83 0.24 Allowed 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.285 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -62.04 -30.77 71.2 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 119.467 -0.893 . . . . 0.0 109.798 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.455 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 45.6 tt0 -63.14 -37.53 87.6 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.79 -29.97 69.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.258 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -27.81 64.14 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.498 178.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -78.59 -31.75 47.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.553 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.65 -33.34 66.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.861 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.47 ' O ' ' HB2' ' B' ' 68' ' ' PHE . 3.9 mp -63.11 -26.2 68.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.378 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' B' ' 69' ' ' LEU . 3.2 m-85 68.77 -60.52 0.44 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.631 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' B' ' 68' ' ' PHE . 2.0 mt 69.51 -64.58 0.34 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.818 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' B' ' 70' ' ' LEU . 30.7 mt -137.57 53.86 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.973 0.416 . . . . 0.0 110.666 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.895 HG23 HG23 ' A' ' 71' ' ' ILE . 36.8 mm -127.21 -44.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.173 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 72' ' ' PHE . . . . . 0.43 ' CD2' ' O ' ' B' ' 72' ' ' PHE . 37.7 p90 -47.96 105.42 0.49 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.212 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -79.11 132.69 10.56 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.532 2.154 . . . . 0.0 112.24 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.2 -50.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.12 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.34 31.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.88 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -141.79 136.9 31.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.856 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 mt 65.47 83.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.047 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 78' ' ' ASP . . . . . 0.473 ' HB3' ' HB2' ' B' ' 81' ' ' LEU . 4.0 t0 -173.36 88.37 0.07 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.856 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.515 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 13.7 ptt? -53.02 -45.2 67.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.639 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.925 HG13 HD11 ' A' ' 81' ' ' LEU . 45.0 mm -65.22 -49.49 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.686 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.896 HD11 HG13 ' A' ' 80' ' ' ILE . 1.2 mm? -64.96 -21.22 66.8 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' LYS . . . . . 0.515 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 8.9 pttp -93.64 -24.66 17.81 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 83' ' ' MET . . . . . 0.518 ' HE3' HD13 ' B' ' 80' ' ' ILE . 18.4 ptp -93.87 -15.22 25.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.621 0.248 . . . . 0.0 111.651 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.74 -65.33 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.726 0.298 . . . . 0.0 110.975 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 43.0 m 65.13 64.89 0.6 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.786 HD23 HG13 ' A' ' 89' ' ' ILE . 1.2 mp -149.43 32.74 0.72 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.738 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -113.15 -36.05 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.199 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.634 ' O ' HD13 ' B' ' 92' ' ' LEU . 2.3 m-20 -71.72 -13.45 61.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 111.047 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.651 HG13 HD23 ' A' ' 86' ' ' LEU . 26.0 mm -86.15 -57.43 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 94' ' ' THR . 30.1 tt0 -63.9 -19.08 64.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.354 178.019 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 91' ' ' ALA . . . . . 0.709 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -83.84 -67.55 0.78 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.653 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.634 HD13 ' O ' ' B' ' 88' ' ' ASP . 6.5 mp -49.31 -29.37 5.93 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.961 0.41 . . . . 0.0 110.37 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.476 ' HG ' ' HA ' ' A' ' 90' ' ' GLU . 4.3 mm? -85.14 -38.93 18.47 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.56 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.709 HG22 ' HA ' ' B' ' 91' ' ' ALA . 8.8 t -73.15 -7.7 52.55 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.983 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -112.92 -32.49 2.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.857 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 2.8 mm? -98.39 -7.39 28.83 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 117.023 0.411 . . . . 0.0 111.753 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 44.5 p90 31.82 42.11 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.843 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.4 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.396 -179.786 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.784 0.326 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.642 ' C ' HD12 ' A' ' 54' ' ' LEU . 18.6 p-80 -106.72 86.94 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.036 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.642 HD12 ' C ' ' A' ' 53' ' ' HIS . 11.1 mp -128.41 8.93 6.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.301 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.492 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.2 OUTLIER -52.8 -56.29 16.79 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.612 -179.796 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.66 -42.64 64.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.247 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.738 ' HB ' HG11 ' B' ' 57' ' ' VAL . 2.5 t -62.99 -38.71 82.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 CA-C-O 120.868 0.366 . . . . 0.0 111.114 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.679 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -61.22 -52.05 66.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.851 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 t -61.28 -20.22 62.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.291 177.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.437 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 11.4 tpp180 -69.66 -73.59 0.15 Allowed 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.346 -179.14 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.845 HD13 HD22 ' A' ' 64' ' ' LEU . 4.2 mm? -62.63 -30.16 71.15 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.024 -1.071 . . . . 0.0 110.025 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.63 ' HB2' HD12 ' B' ' 61' ' ' LEU . 65.4 tt0 -62.5 -36.67 83.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.314 177.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.86 -15.28 48.77 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.845 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -86.27 -21.48 27.34 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.239 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.549 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 2.4 mm-40 -112.47 -18.32 12.46 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.331 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.29 89.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.405 ' N ' ' O ' ' A' ' 65' ' ' GLU . 7.0 mt 62.78 17.1 9.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.38 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.417 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 1.4 t80 -103.51 98.4 8.3 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.728 0.299 . . . . 0.0 111.026 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tt -177.19 -72.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.024 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.27 -39.02 0.15 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.915 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.637 HG23 HG12 ' A' ' 80' ' ' ILE . 16.6 mm -48.72 -26.99 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.566 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.73 77.19 0.39 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.847 0.356 . . . . 0.0 111.0 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.26 -46.66 1.34 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.575 2.183 . . . . 0.0 112.3 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.56 74.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.003 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 67.84 -69.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.058 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -70.66 138.67 50.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 pp -100.55 131.4 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.912 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.89 -38.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.954 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.06 -23.18 31.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.096 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.637 HG12 HG23 ' A' ' 71' ' ' ILE . 2.9 mp -62.6 -50.76 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.335 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.37 -11.13 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.475 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -88.55 -22.92 23.32 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.67 0.271 . . . . 0.0 111.191 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.5 mtm -116.1 -43.54 2.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.353 . . . . 0.0 111.002 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.53 89.69 3.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.869 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 87.6 p -158.35 154.81 27.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.08 13.69 18.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.261 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.84 17.21 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.246 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.793 ' O ' HD23 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -73.35 -14.61 61.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.07 179.779 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.415 ' CG2' ' HB ' ' B' ' 89' ' ' ILE . 10.6 mm -92.99 -50.37 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.421 ' OE2' HD23 ' B' ' 93' ' ' LEU . 3.8 tt0 -63.4 -21.86 66.54 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.93 -52.0 5.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.1 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 88' ' ' ASP . 2.3 mm? -52.33 -27.34 14.99 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.182 0.515 . . . . 0.0 109.619 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.596 HD12 HD12 ' B' ' 93' ' ' LEU . 0.2 OUTLIER -91.01 -36.93 13.78 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.04 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.21 -13.62 50.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.872 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.71 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.214 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.54 HD13 ' O ' ' A' ' 96' ' ' LEU . 0.2 OUTLIER -101.22 3.63 41.11 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.559 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.662 ' O ' HG12 ' A' ' 98' ' ' VAL . 21.2 p90 -41.84 133.22 2.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.596 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.662 HG12 ' O ' ' A' ' 97' ' ' PHE . 3.0 p . . . . . 0 N--CA 1.462 0.173 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.992 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.846 0.355 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.633 ' C ' HD12 ' B' ' 54' ' ' LEU . 18.3 p-80 -106.83 87.04 2.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.942 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.633 HD12 ' C ' ' B' ' 53' ' ' HIS . 11.0 mp -128.38 8.91 6.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.418 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.489 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -52.77 -56.33 16.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 111.523 -179.787 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.77 -42.59 65.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.227 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.738 HG11 ' HB ' ' A' ' 57' ' ' VAL . 2.4 t -62.82 -38.76 82.64 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-O 120.926 0.393 . . . . 0.0 111.172 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.659 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -61.26 -52.08 66.24 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 7.7 t -61.29 -20.26 62.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.381 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.445 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 11.5 tpp180 -69.69 -73.58 0.16 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.297 -179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.822 HD13 HD22 ' B' ' 64' ' ' LEU . 4.2 mm? -62.45 -30.45 71.25 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.081 -1.048 . . . . 0.0 110.018 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.634 ' HB2' HD12 ' A' ' 61' ' ' LEU . 65.3 tt0 -62.45 -36.49 82.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.372 177.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.94 -15.3 48.4 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.634 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.822 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -86.32 -21.5 27.24 Favored 'General case' 0 CA--C 1.523 -0.093 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.289 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 2.4 mm-40 -112.38 -18.43 12.47 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.384 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.23 89.19 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.952 0.406 . . . . 0.0 111.007 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.403 ' N ' ' O ' ' B' ' 65' ' ' GLU . 7.0 mt 62.92 16.87 9.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.359 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' B' ' 64' ' ' LEU . 1.4 t80 -103.32 98.34 8.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.758 0.314 . . . . 0.0 110.994 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tp -176.93 -73.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.998 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 -39.02 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.981 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.613 HG23 HG12 ' B' ' 80' ' ' ILE . 16.5 mm -48.57 -27.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.637 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.78 77.22 0.39 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.972 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.1 -46.59 1.43 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.525 2.15 . . . . 0.0 112.429 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.57 74.0 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 67.8 -67.83 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.145 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.28 138.17 49.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.979 0.418 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.17 129.98 46.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.828 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.55 -38.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.936 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.07 -23.2 32.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.172 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.613 HG12 HG23 ' B' ' 71' ' ' ILE . 2.9 mp -62.36 -50.95 77.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.376 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.4 -11.0 47.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.55 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -88.66 -22.77 23.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.739 0.304 . . . . 0.0 111.265 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.6 mtm -116.26 -43.52 2.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.91 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.57 89.74 3.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 86.5 p -158.4 154.8 27.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.833 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 mt -92.06 13.67 18.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.93 17.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.272 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.777 ' O ' HD23 ' B' ' 92' ' ' LEU . 0.3 OUTLIER -73.36 -14.54 61.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.102 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.415 ' HB ' ' CG2' ' A' ' 89' ' ' ILE . 10.6 mm -93.05 -50.34 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.425 ' OE2' HD23 ' A' ' 93' ' ' LEU . 3.8 tt0 -63.39 -21.82 66.52 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 177.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.04 -51.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.994 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.777 HD23 ' O ' ' B' ' 88' ' ' ASP . 2.3 mm? -52.35 -27.32 15.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.282 0.563 . . . . 0.0 109.597 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.596 HD12 HD12 ' A' ' 93' ' ' LEU . 0.2 OUTLIER -91.08 -36.84 13.78 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.078 178.981 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.18 -13.71 50.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.916 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.7 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.195 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.547 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -101.19 3.72 41.28 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.669 ' O ' HG12 ' B' ' 98' ' ' VAL . 21.4 p90 -41.82 133.16 2.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.698 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 98' ' ' VAL . . . . . 0.669 HG12 ' O ' ' B' ' 97' ' ' PHE . 3.0 p . . . . . 0 CA--C 1.532 0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.048 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' CB ' ' A' ' 55' ' ' THR . . . . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.564 0.221 . . . . 0.0 111.255 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.587 ' O ' HG21 ' B' ' 57' ' ' VAL . 14.4 m-70 63.6 -80.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.977 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.506 HD23 HG13 ' B' ' 57' ' ' VAL . 0.8 OUTLIER -94.78 -68.12 0.82 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.827 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.665 ' CB ' ' HB1' ' A' ' 52' ' ' ALA . 97.9 m 22.23 -86.17 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.8 mt-10 -60.06 -68.34 0.3 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.87 0.367 . . . . 0.0 111.495 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.6 HG21 ' O ' ' B' ' 53' ' ' HIS . 41.4 t -56.77 -21.78 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.672 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.692 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.9 pt-20 -70.31 -45.95 65.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.429 ' N ' ' HG2' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -68.52 -17.15 64.1 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.241 -0.89 . . . . 0.0 108.961 177.136 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 0.4 OUTLIER -73.76 -75.23 0.16 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.529 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.3 mm? -60.62 -29.11 69.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.072 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.659 ' HB2' HD12 ' B' ' 61' ' ' LEU . 3.5 tt0 -66.35 -38.2 87.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.051 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 59' ' ' SER . 6.2 ttt85 -66.83 -27.69 67.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.4 HD11 HD21 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -75.42 -27.31 58.96 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.601 178.649 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 8.4 tm-20 -78.29 -30.06 48.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.403 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.42 -31.14 69.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.712 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.49 -10.77 45.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.226 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 63.41 143.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.787 0.327 . . . . 0.0 110.983 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.441 HD11 ' OE1' ' B' ' 65' ' ' GLU . 2.3 mt -93.84 -63.49 1.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.845 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 31.5 mt -147.0 33.53 0.91 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.4 HD12 ' CZ ' ' B' ' 68' ' ' PHE . 23.6 mm -89.74 -58.81 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.218 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.3 112.24 46.7 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.975 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.51 -160.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.52 2.147 . . . . 0.0 112.285 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -134.56 162.1 33.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.348 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 56.52 -157.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.669 0.271 . . . . 0.0 110.927 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -78.41 -38.07 42.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.523 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.5 mt -46.94 114.47 0.85 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.076 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.487 ' OD2' HD11 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -130.72 106.28 8.36 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.13 0.49 . . . . 0.0 112.001 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.471 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -68.88 -39.2 79.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.615 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.91 -46.84 95.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.879 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.558 ' CD2' HD23 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -78.95 -25.75 43.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.923 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.471 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -84.59 -18.39 35.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.329 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 32.3 mtm -107.92 -23.29 12.1 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.539 ' CB ' HD13 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -58.19 -75.0 0.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.8 0.334 . . . . 0.0 111.304 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -174.27 127.65 0.35 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.116 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.47 HD23 ' O ' ' A' ' 81' ' ' LEU . 1.2 pp -158.43 29.34 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.585 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -97.42 -15.34 20.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.266 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 65.1 m-20 -70.6 -12.09 61.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.913 0.387 . . . . 0.0 111.163 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.644 ' HB ' HG21 ' B' ' 89' ' ' ILE . 11.2 mm -86.92 -57.51 4.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 94' ' ' THR . 40.0 tt0 -63.28 -19.21 64.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.179 177.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.597 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -83.27 -68.64 0.69 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.258 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.439 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.3 tt -47.52 -28.27 2.16 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.118 0.485 . . . . 0.0 110.263 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 89' ' ' ILE . 0.3 OUTLIER -83.25 -40.47 19.55 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.644 179.125 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.597 HG22 ' HA ' ' A' ' 91' ' ' ALA . 4.0 t -69.22 -9.53 53.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.889 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.94 -33.57 3.0 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.197 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.7 OUTLIER -87.77 -8.04 56.52 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 120.974 0.416 . . . . 0.0 111.058 179.282 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.434 ' CE1' ' HB ' ' B' ' 98' ' ' VAL . 0.3 OUTLIER 65.98 -152.66 0.24 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.297 -179.466 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.434 ' HB ' ' CE1' ' B' ' 97' ' ' PHE . 21.8 t . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 120.754 0.312 . . . . 0.0 111.114 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' CB ' ' B' ' 55' ' ' THR . . . . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.703 0.287 . . . . 0.0 111.136 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.6 ' O ' HG21 ' A' ' 57' ' ' VAL . 14.4 m-70 63.58 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.528 HD23 HG13 ' A' ' 57' ' ' VAL . 0.8 OUTLIER -94.74 -68.05 0.82 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.864 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.665 ' CB ' ' HB1' ' B' ' 52' ' ' ALA . 97.7 m 22.16 -86.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.8 mt-10 -60.0 -68.3 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 0.0 111.452 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.587 HG21 ' O ' ' A' ' 53' ' ' HIS . 41.7 t -56.84 -21.74 14.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.658 -179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.691 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.9 pt-20 -70.32 -46.0 65.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' HG2' ' B' ' 58' ' ' GLU . 0.3 OUTLIER -68.39 -17.3 64.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.006 177.138 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.526 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 0.4 OUTLIER -73.74 -75.2 0.16 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.553 -179.806 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.3 mm? -60.38 -29.38 68.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.144 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.662 ' HB2' HD12 ' A' ' 61' ' ' LEU . 3.6 tt0 -66.35 -38.09 86.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 63' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' B' ' 59' ' ' SER . 6.2 ttt85 -66.88 -27.76 67.77 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -27.29 59.1 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.544 0.687 . . . . 0.0 109.626 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.441 ' OE1' HD11 ' A' ' 69' ' ' LEU . 8.5 tm-20 -78.25 -30.12 48.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.382 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 -31.15 69.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.669 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.42 -10.8 45.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.353 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.4 ' CZ ' HD12 ' A' ' 71' ' ' ILE . 97.2 m-85 63.56 143.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.814 0.34 . . . . 0.0 110.949 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.0 tp -93.49 -63.62 1.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.984 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 30.6 mt -146.83 33.55 0.93 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.855 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -89.71 -58.87 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.166 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.24 112.22 46.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.952 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.43 -160.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.527 2.151 . . . . 0.0 112.313 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -134.22 164.0 28.36 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -52.65 96.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.168 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 179.06 -38.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.259 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.9 tp 179.66 148.53 0.27 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.426 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 78' ' ' ASP . . . . . 0.49 ' OD2' HD11 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -116.97 104.68 11.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.077 0.465 . . . . 0.0 110.808 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.478 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 0.0 OUTLIER -68.42 -39.06 81.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.621 -179.429 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -62.03 -46.78 95.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.558 HD23 ' CD2' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -79.06 -25.54 43.13 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.0 -178.955 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 82' ' ' LYS . . . . . 0.478 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 0.0 OUTLIER -84.84 -18.43 34.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.354 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 32.6 mtm -107.84 -23.18 12.16 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' ASP . . . . . 0.549 ' CB ' HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -58.39 -74.83 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.727 0.299 . . . . 0.0 111.257 -179.52 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 85' ' ' SER . . . . . 0.452 ' C ' HD23 ' B' ' 86' ' ' LEU . 1.5 m -174.43 127.71 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.194 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.513 HD23 ' N ' ' B' ' 86' ' ' LEU . 0.4 OUTLIER -158.41 28.93 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.613 179.776 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -96.89 -15.45 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.284 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 65.4 m-20 -70.73 -12.01 61.3 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.077 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.644 HG21 ' HB ' ' A' ' 89' ' ' ILE . 11.2 mm -86.76 -57.65 4.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.582 ' O ' ' HB ' ' B' ' 94' ' ' THR . 40.0 tt0 -63.31 -19.19 64.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.187 177.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 91' ' ' ALA . . . . . 0.599 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -83.23 -68.63 0.69 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.345 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.435 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.3 tt -47.56 -28.33 2.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.959 0.409 . . . . 0.0 110.128 179.202 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.559 HD12 ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER -83.18 -40.5 19.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.679 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.599 HG22 ' HA ' ' B' ' 91' ' ' ALA . 4.0 t -69.1 -9.67 53.84 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.841 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.98 -33.54 3.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.128 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 0.7 OUTLIER -87.83 -8.02 56.46 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.008 0.432 . . . . 0.0 111.104 179.286 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.434 ' CE1' ' HB ' ' A' ' 98' ' ' VAL . 0.4 OUTLIER 66.01 -152.74 0.24 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.214 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 98' ' ' VAL . . . . . 0.434 ' HB ' ' CE1' ' A' ' 97' ' ' PHE . 21.9 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 111.15 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.064 0 CA-C-O 120.891 0.377 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.723 ' O ' HG22 ' B' ' 57' ' ' VAL . 0.0 OUTLIER 64.99 74.39 0.39 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.143 179.905 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.606 HD23 ' HB2' ' A' ' 58' ' ' GLU . 1.5 mt -147.14 -96.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.516 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 0.2 OUTLIER 37.82 -142.73 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.099 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.71 -64.17 0.19 Allowed 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.703 HG22 ' O ' ' B' ' 53' ' ' HIS . 34.0 t -50.45 -37.21 14.59 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.657 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.3 pt-20 -61.36 -48.09 82.9 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.471 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -66.27 -15.64 63.37 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.381 177.802 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.452 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 29.2 ttm-85 -72.96 -71.35 0.31 Allowed 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.554 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.69 HD13 HD22 ' A' ' 64' ' ' LEU . 4.4 mm? -64.58 -27.29 68.85 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.851 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.448 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 1.9 tt0 -68.58 -33.44 74.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.57 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.0 OUTLIER -81.4 -19.37 42.73 Favored 'General case' 0 C--O 1.231 0.102 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.452 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.69 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -82.98 -24.01 33.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.253 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' B' ' 65' ' ' GLU . 0.6 OUTLIER -93.93 -65.14 1.01 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.655 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.449 ' O ' ' CB ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.33 133.89 53.55 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.471 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.5 OUTLIER 83.4 -45.73 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.777 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.65 88.7 3.29 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.969 0.414 . . . . 0.0 110.669 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.07 161.2 38.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.738 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.63 -19.49 58.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.273 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.581 ' O ' HG22 ' A' ' 71' ' ' ILE . 15.7 mm -125.05 27.51 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.643 0.259 . . . . 0.0 111.633 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.435 ' CE2' ' HB2' ' A' ' 74' ' ' ARG . 5.1 p90 -58.04 137.29 84.03 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.006 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.468 2.112 . . . . 0.0 112.335 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.435 ' HB2' ' CE2' ' A' ' 72' ' ' PHE . 0.0 OUTLIER -169.06 -65.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -70.94 0.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 61.39 154.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.78 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 pp -150.11 26.64 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.136 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 62.56 69.52 0.6 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.935 0.397 . . . . 0.0 110.893 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 29.0 mtp -65.27 -49.16 70.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.692 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.421 HG22 HD11 ' B' ' 81' ' ' LEU . 2.0 mp -76.6 -41.19 34.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.727 HD12 HD12 ' B' ' 81' ' ' LEU . 1.0 OUTLIER -60.15 -30.15 69.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.661 179.665 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.45 -29.75 18.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.392 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.81 -24.24 63.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.769 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.6 96.63 10.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.5 m -54.06 109.92 0.54 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.179 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 pp -139.39 26.39 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.56 -21.88 13.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -7.01 49.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 0.0 111.105 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.696 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.6 mp -91.79 -54.05 7.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.44 ' HG3' HG21 ' B' ' 89' ' ' ILE . 0.0 OUTLIER -66.63 -20.88 66.09 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.2 178.014 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -56.83 3.16 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.265 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.522 HD23 HG11 ' A' ' 98' ' ' VAL . 32.8 tp -54.76 -24.09 20.91 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.694 ' HG ' HG12 ' A' ' 98' ' ' VAL . 11.2 mt -92.24 -39.53 11.48 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.544 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.65 -13.85 61.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.146 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.11 -40.89 0.46 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.422 -0.894 . . . . 0.0 113.345 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 96' ' ' LEU . 3.9 mm? -111.71 -0.44 16.0 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 30.4 p90 39.53 53.4 2.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.603 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.694 HG12 ' HG ' ' A' ' 93' ' ' LEU . 11.6 p . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.357 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.817 0.342 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.703 ' O ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 65.06 74.4 0.39 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.033 179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.591 HD23 ' HB2' ' B' ' 58' ' ' GLU . 1.5 mt -147.1 -96.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.5 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.52 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 0.2 OUTLIER 37.67 -142.77 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 179.077 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.67 -64.15 0.19 Allowed 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.723 HG22 ' O ' ' A' ' 53' ' ' HIS . 34.6 t -50.6 -37.14 15.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.779 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.667 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.3 pt-20 -61.28 -48.09 83.02 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.468 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 0.2 OUTLIER -66.33 -15.46 63.27 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.521 177.762 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.465 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 28.8 ttm-85 -73.01 -71.26 0.31 Allowed 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.63 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.694 HD13 HD22 ' B' ' 64' ' ' LEU . 4.4 mm? -64.53 -27.45 68.97 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.842 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.445 ' HB2' HD12 ' A' ' 61' ' ' LEU . 1.9 tt0 -68.53 -33.52 74.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.503 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 63' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.0 OUTLIER -81.49 -19.2 42.78 Favored 'General case' 0 C--O 1.231 0.109 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.616 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.694 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -83.01 -23.95 33.05 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.244 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -94.06 -65.15 1.01 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.599 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 67' ' ' LEU . 0.0 OUTLIER -64.4 133.97 53.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.214 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.465 HD13 ' O ' ' B' ' 67' ' ' LEU . 0.5 OUTLIER 83.33 -45.74 0.12 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.756 -179.328 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.68 88.48 3.23 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.867 0.365 . . . . 0.0 110.586 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.573 HD13 ' H ' ' B' ' 70' ' ' LEU . 0.2 OUTLIER -158.11 160.09 36.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.59 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.573 ' H ' HD13 ' B' ' 69' ' ' LEU . 14.7 mt -59.64 -19.56 50.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.273 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.581 HG22 ' O ' ' B' ' 71' ' ' ILE . 15.7 mm -124.98 27.53 2.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.595 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 72' ' ' PHE . . . . . 0.435 ' CE2' ' HB2' ' B' ' 74' ' ' ARG . 5.1 p90 -58.04 137.34 84.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.966 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.568 2.179 . . . . 0.0 112.283 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 74' ' ' ARG . . . . . 0.435 ' HB2' ' CE2' ' B' ' 72' ' ' PHE . 0.0 OUTLIER -168.96 -65.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.114 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -125.31 122.83 37.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.19 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 p30 -66.89 173.73 3.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.789 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp 177.56 -30.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.177 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 64.17 69.24 0.53 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.902 0.382 . . . . 0.0 110.696 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 29.1 mtp -65.16 -49.3 70.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.675 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.42 HG22 HD11 ' A' ' 81' ' ' LEU . 2.0 mp -76.43 -41.25 35.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.727 HD12 HD12 ' A' ' 81' ' ' LEU . 1.0 OUTLIER -60.15 -30.19 69.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.558 179.765 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.58 -29.7 18.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.296 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.76 -24.3 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.712 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.64 96.57 10.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.638 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 5.4 m -54.01 109.82 0.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.601 ' O ' HD12 ' B' ' 86' ' ' LEU . 3.2 pp -139.43 26.67 2.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.992 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.74 -21.92 13.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.922 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' B' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -6.97 49.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.061 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.694 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.6 mp -91.79 -54.03 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.414 ' HG3' HG21 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -66.61 -20.8 66.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.237 177.96 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.35 -56.69 3.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.247 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.498 HD23 HG11 ' B' ' 98' ' ' VAL . 33.4 tp -54.82 -24.1 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.97 0.414 . . . . 0.0 109.908 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.7 ' HG ' HG12 ' B' ' 98' ' ' VAL . 11.1 mt -92.28 -39.57 11.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.47 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.94 61.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.13 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.06 -40.84 0.47 Allowed Glycine 0 CA--C 1.519 0.3 0 C-N-CA 120.42 -0.895 . . . . 0.0 113.354 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.76 -0.45 15.95 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 30.0 p90 39.52 53.43 2.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.571 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 98' ' ' VAL . . . . . 0.7 HG12 ' HG ' ' B' ' 93' ' ' LEU . 11.6 p . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.353 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.928 0.394 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.619 ' O ' HG21 ' B' ' 57' ' ' VAL . 3.1 m-70 -116.75 -66.49 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.63 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.865 HD23 ' OE1' ' A' ' 58' ' ' GLU . 5.0 mp -54.62 -81.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.426 HG22 ' O ' ' A' ' 54' ' ' LEU . 13.2 t 42.72 -151.19 0.03 OUTLIER 'General case' 0 C--O 1.24 0.576 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 178.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 15.1 mt-10 -38.02 -41.46 0.56 Allowed 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.575 -178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.61 HG21 ' O ' ' B' ' 53' ' ' HIS . 51.6 t -64.44 -42.74 96.16 Favored 'Isoleucine or valine' 0 C--O 1.251 1.143 0 CA-C-O 121.362 0.601 . . . . 0.0 110.922 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.942 ' O ' HD23 ' B' ' 61' ' ' LEU . 1.1 pt-20 -59.04 -54.5 46.34 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.503 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 94.0 p -61.67 -17.56 56.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.657 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.464 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.8 -71.49 0.22 Allowed 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.871 -179.115 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.959 HD23 ' O ' ' B' ' 58' ' ' GLU . 0.0 OUTLIER -67.8 -19.97 65.14 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.787 -179.335 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.406 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.21 77.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.901 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.6 mtp85 -85.78 -18.66 32.34 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.215 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.803 HD13 ' CD1' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -75.85 -34.22 60.06 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.144 0.497 . . . . 0.0 110.407 179.639 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.551 ' N ' HD23 ' A' ' 64' ' ' LEU . 0.5 OUTLIER -96.49 -28.84 14.22 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.129 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.03 42.31 3.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.127 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.31 119.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.26 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HB2' ' CD2' ' B' ' 68' ' ' PHE . 4.0 t80 -151.4 124.0 8.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.985 0.422 . . . . 0.0 110.971 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tp -175.23 -39.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.07 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -103.82 26.01 9.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 21.6 mt -114.01 -24.87 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.173 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 63.45 123.36 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.732 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -84.17 87.11 1.19 Allowed 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.683 2.255 . . . . 0.0 112.654 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.7 mtp-105 56.47 34.12 23.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.243 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.85 104.54 14.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 75.4 -76.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.494 HD22 HD11 ' B' ' 80' ' ' ILE . 6.6 mp 53.95 68.2 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.026 0.441 . . . . 0.0 110.88 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -114.3 -19.02 11.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.674 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.1 -40.81 74.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.742 0.306 . . . . 0.0 111.045 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mm -67.3 -44.11 87.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.117 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.831 HD12 HD12 ' B' ' 81' ' ' LEU . 3.7 mp -65.27 -24.3 67.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.921 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.07 -26.81 22.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.937 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 39.7 mtp -85.17 -20.28 30.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.101 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.593 ' HB3' HD21 ' B' ' 81' ' ' LEU . 3.9 t0 -99.5 28.02 4.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.77 0.319 . . . . 0.0 110.98 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 168.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.061 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.481 ' CA ' HD13 ' A' ' 89' ' ' ILE . 2.5 mt -176.09 -40.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.897 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.92 -30.62 22.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.811 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.687 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -71.06 -9.93 58.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.169 179.72 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.707 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.4 mp -91.65 -55.97 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.54 -20.9 65.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.524 -0.762 . . . . 0.0 108.982 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.2 -49.98 6.91 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.883 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.687 HD12 ' O ' ' A' ' 88' ' ' ASP . 4.4 mt -53.97 -26.75 27.43 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 3.8 mm? -91.9 -36.88 13.22 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.997 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.19 -14.82 57.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.964 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.47 -29.79 1.26 Allowed Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.498 -0.858 . . . . 0.0 113.21 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.649 ' O ' HG23 ' A' ' 98' ' ' VAL . 1.0 OUTLIER -100.12 2.87 43.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.962 0.381 . . . . 0.0 111.956 -179.521 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.423 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 24.5 p90 -38.89 137.54 0.65 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.679 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 96' ' ' LEU . 21.7 t . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.991 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.834 0.349 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.61 ' O ' HG21 ' A' ' 57' ' ' VAL . 3.1 m-70 -116.71 -66.27 1.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.725 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.861 HD23 ' OE1' ' B' ' 58' ' ' GLU . 5.0 mp -54.72 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.726 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.433 HG22 ' O ' ' B' ' 54' ' ' LEU . 13.3 t 42.81 -151.25 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.405 ' N ' HG23 ' B' ' 55' ' ' THR . 14.8 mt-10 -38.04 -41.37 0.56 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.613 -178.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.619 HG21 ' O ' ' A' ' 53' ' ' HIS . 52.5 t -64.46 -42.87 96.52 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.297 0.57 . . . . 0.0 110.798 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.959 ' O ' HD23 ' A' ' 61' ' ' LEU . 1.1 pt-20 -58.97 -54.65 44.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.509 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 94.1 p -61.47 -17.73 55.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.728 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.65 -71.63 0.21 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.857 -179.132 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.942 HD23 ' O ' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -67.69 -19.97 65.23 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.834 -179.281 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.44 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.25 77.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.886 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 63' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.6 mtp85 -85.7 -18.69 32.38 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.169 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.803 HD13 ' CD1' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -75.88 -34.16 59.99 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.14 0.495 . . . . 0.0 110.365 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.549 ' N ' HD23 ' B' ' 64' ' ' LEU . 0.5 OUTLIER -96.64 -28.78 14.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.115 179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 65.83 42.47 3.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.22 118.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.465 ' CD2' ' HB2' ' A' ' 68' ' ' PHE . 4.0 t80 -151.28 123.64 8.34 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.024 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -174.75 -39.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.075 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mt -104.16 26.14 9.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.159 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.424 ' HB ' ' CE1' ' B' ' 68' ' ' PHE . 21.4 mt -113.98 -24.82 3.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.246 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 63.54 123.28 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.696 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -84.3 86.92 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.778 2.318 . . . . 0.0 112.552 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.0 mtp-105 53.88 24.45 4.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.805 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -83.79 -73.55 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.342 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.91 88.16 2.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.937 0.398 . . . . 0.0 110.755 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.63 67.97 0.92 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -105.64 -19.8 13.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -40.75 75.29 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.494 HD11 HD22 ' A' ' 77' ' ' LEU . 34.9 mm -67.34 -44.2 87.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.018 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.831 HD12 HD12 ' A' ' 81' ' ' LEU . 3.6 mp -65.33 -24.09 67.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.19 -26.82 22.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.98 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 39.8 mtp -85.1 -20.37 30.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.15 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' ASP . . . . . 0.582 ' HB3' HD21 ' A' ' 81' ' ' LEU . 3.8 t0 -99.48 28.13 4.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.073 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t 57.45 168.05 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.48 ' CA ' HD13 ' B' ' 89' ' ' ILE . 0.5 OUTLIER -176.06 -40.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.926 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.75 -30.74 22.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.91 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.681 ' O ' HD12 ' B' ' 92' ' ' LEU . 0.2 OUTLIER -70.89 -10.13 59.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.688 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.5 mp -91.57 -56.01 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -62.52 -20.9 65.08 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.045 177.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 -49.92 6.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.0 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.681 HD12 ' O ' ' B' ' 88' ' ' ASP . 4.4 mt -54.01 -26.74 27.77 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 3.8 mm? -91.84 -36.92 13.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.013 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.12 -14.87 57.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.986 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.41 -29.96 1.24 Allowed Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.199 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.648 ' O ' HG23 ' B' ' 98' ' ' VAL . 1.0 OUTLIER -100.04 2.87 43.76 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.583 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 24.4 p90 -38.82 137.5 0.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.643 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 98' ' ' VAL . . . . . 0.648 HG23 ' O ' ' B' ' 96' ' ' LEU . 21.7 t . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.929 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.81 0.338 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -126.62 85.38 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.776 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.59 HD12 HG13 ' B' ' 57' ' ' VAL . 19.6 tp -172.7 -100.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.017 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.493 ' C ' ' O ' ' A' ' 54' ' ' LEU . 38.4 m 6.35 -72.75 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -59.96 -68.52 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.997 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.593 HG13 HD12 ' B' ' 54' ' ' LEU . 24.5 t -55.53 -48.56 77.2 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.603 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.2 pt-20 -51.72 -47.29 64.06 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.387 0.613 . . . . 0.0 109.469 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.414 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 4.9 t -67.61 -19.51 65.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.577 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.445 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -69.21 -68.53 0.4 Allowed 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.466 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.668 ' HG ' ' HB2' ' B' ' 62' ' ' GLU . 3.6 mm? -62.91 -42.46 99.8 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.802 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.643 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 69.7 tt0 -50.8 -35.96 34.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.255 177.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.45 -26.59 46.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.913 0.387 . . . . 0.0 110.035 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -27.16 68.3 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.3 0.571 . . . . 0.0 109.742 179.01 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 66' ' ' GLN . 25.2 tt0 -99.56 -21.23 15.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.882 178.392 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 65' ' ' GLU . 17.3 pt20 50.53 35.26 10.92 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.482 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.445 ' O ' ' CB ' ' A' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 11.0 7.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.925 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.817 ' CE1' HD22 ' B' ' 69' ' ' LEU . 0.4 OUTLIER 158.58 137.69 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.471 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.877 ' HG ' HG22 ' A' ' 71' ' ' ILE . 0.7 OUTLIER -66.42 -165.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.34 179.458 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.74 -15.51 58.74 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.877 HG22 ' HG ' ' A' ' 69' ' ' LEU . 0.7 OUTLIER -57.18 -28.86 30.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.716 0.293 . . . . 0.0 111.539 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.19 92.95 5.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.164 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.75 -7.6 21.04 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.579 2.186 . . . . 0.0 112.663 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 65.9 49.71 1.61 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.351 . . . . 0.0 110.918 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -176.27 -51.04 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -108.59 135.07 50.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.961 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.401 ' O ' HD12 ' A' ' 77' ' ' LEU . 1.6 pp -109.36 30.12 6.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.96 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 30.54 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -49.72 57.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.415 HG13 HD12 ' A' ' 71' ' ' ILE . 37.9 mm -61.72 -45.51 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.989 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 mt -66.11 -30.4 70.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.524 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -74.86 -28.97 60.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.855 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.03 -73.93 0.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.577 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.39 116.4 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.624 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.554 ' HB2' HD21 ' B' ' 86' ' ' LEU . 0.7 OUTLIER 75.49 -161.93 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.777 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 64.92 26.07 12.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.751 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -148.94 -40.88 0.15 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.912 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.22 -8.3 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.881 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.534 HG21 ' HB ' ' B' ' 89' ' ' ILE . 13.0 mm -89.36 -56.87 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.524 ' O ' ' HB ' ' A' ' 94' ' ' THR . 2.5 tm-20 -64.89 -19.88 66.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.493 178.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.787 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.48 -58.74 2.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.641 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 25.5 tp -55.85 -24.27 35.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.289 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.572 ' HG ' HG12 ' A' ' 98' ' ' VAL . 1.0 OUTLIER -92.38 -39.79 11.25 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.066 179.668 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.787 HG22 ' HA ' ' A' ' 91' ' ' ALA . 11.4 t -69.94 -11.49 60.91 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.898 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.33 -35.85 1.06 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.753 -0.737 . . . . 0.0 113.19 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 96' ' ' LEU . 0.2 OUTLIER -95.71 -5.42 42.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 117.015 0.408 . . . . 0.0 112.015 -179.565 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.426 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 25.6 p90 37.26 93.97 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.033 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.572 HG12 ' HG ' ' A' ' 93' ' ' LEU . 12.2 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.184 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.835 0.35 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -126.54 85.43 2.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.593 HD12 HG13 ' A' ' 57' ' ' VAL . 19.7 tp -172.81 -100.37 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.028 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.483 ' C ' ' O ' ' B' ' 54' ' ' LEU . 38.9 m 6.46 -72.87 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -59.95 -68.53 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.007 -178.923 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.59 HG13 HD12 ' A' ' 54' ' ' LEU . 25.0 t -55.68 -48.17 78.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.714 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.622 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 pt-20 -52.01 -47.28 65.04 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.425 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 4.8 t -67.41 -19.56 65.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.666 178.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.452 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -69.26 -68.59 0.39 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.426 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.643 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 3.6 mm? -62.9 -42.43 99.78 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 119.377 -0.929 . . . . 0.0 108.742 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.668 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 69.7 tt0 -50.85 -35.83 34.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.249 177.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.6 -26.57 45.43 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.918 0.39 . . . . 0.0 110.014 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -27.2 68.37 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.336 0.588 . . . . 0.0 109.723 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.423 ' O ' ' CG ' ' B' ' 66' ' ' GLN . 25.3 tt0 -99.54 -21.35 15.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.837 178.483 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' B' ' 65' ' ' GLU . 17.3 pt20 50.53 35.32 11.07 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.47 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.45 ' O ' ' CB ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 10.8 7.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.958 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.548 ' CE1' HD22 ' A' ' 69' ' ' LEU . 0.3 OUTLIER 158.78 138.61 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.632 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.817 HD22 ' CE1' ' A' ' 68' ' ' PHE . 2.4 tp -66.06 -166.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.439 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 15.8 mt -63.7 -15.44 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.345 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.441 HD12 HG13 ' B' ' 80' ' ' ILE . 0.7 OUTLIER -57.24 -28.66 30.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.715 0.293 . . . . 0.0 111.549 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.28 93.09 5.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.169 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.82 -7.63 21.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.62 2.213 . . . . 0.0 112.695 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 65.74 49.27 1.75 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.922 0.391 . . . . 0.0 110.836 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -170.64 -61.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.835 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -105.35 139.47 39.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.754 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.03 34.16 3.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.5 30.41 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -49.75 56.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.441 HG13 HD12 ' B' ' 71' ' ' ILE . 38.0 mm -61.72 -45.49 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mt -66.05 -30.39 70.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.585 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -75.0 -28.82 60.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.04 -73.92 0.43 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.651 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.36 116.35 10.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.597 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 75.67 -162.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.692 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' ' 85' ' ' SER . 1.1 mm? 64.85 26.18 12.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.847 0.356 . . . . 0.0 110.723 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -148.96 -40.91 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.802 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.27 -8.16 51.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.884 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.534 ' HB ' HG21 ' A' ' 89' ' ' ILE . 12.9 mm -89.37 -56.96 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.521 ' O ' ' HB ' ' B' ' 94' ' ' THR . 2.4 tm-20 -64.93 -19.91 66.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.432 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 91' ' ' ALA . . . . . 0.78 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.33 -58.69 2.49 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.78 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 25.8 tp -55.8 -24.36 35.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.288 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.586 ' HG ' HG12 ' B' ' 98' ' ' VAL . 1.0 OUTLIER -92.25 -39.89 11.27 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.08 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.78 HG22 ' HA ' ' B' ' 91' ' ' ALA . 11.5 t -69.97 -11.47 60.9 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.895 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.4 -35.89 1.05 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.106 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.427 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -95.62 -5.39 42.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 117.162 0.481 . . . . 0.0 112.105 -179.648 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.431 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 25.9 p90 37.25 94.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.13 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 98' ' ' VAL . . . . . 0.586 HG12 ' HG ' ' B' ' 93' ' ' LEU . 12.1 p . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.19 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.793 0.33 . . . . 0.0 111.328 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -157.27 27.46 0.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -101.13 -0.46 36.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.59 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.518 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -56.32 -53.41 57.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.79 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.14 -42.05 63.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.75 ' HB ' HG11 ' B' ' 57' ' ' VAL . 2.9 t -62.59 -41.1 90.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.628 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.594 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 2.4 mt-10 -56.61 -64.1 0.98 Allowed 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.6 m -52.88 -20.51 3.37 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.118 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.01 -73.25 0.15 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.159 -179.31 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.874 ' CD1' HD13 ' A' ' 64' ' ' LEU . 3.6 mm? -61.83 -24.42 66.88 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.145 -1.022 . . . . 0.0 110.208 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.28 -37.19 86.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.49 177.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -20.39 53.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.522 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.874 HD13 ' CD1' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -74.47 -32.07 62.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.46 0.647 . . . . 0.0 110.386 179.404 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.574 ' N ' HD23 ' A' ' 64' ' ' LEU . 3.3 mm-40 -92.81 -23.71 18.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.623 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -58.74 -39.03 79.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.017 0.437 . . . . 0.0 110.366 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.554 ' O ' HD23 ' A' ' 67' ' ' LEU . 9.1 tt -76.46 -11.42 59.88 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.969 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 31.5 t80 76.57 130.93 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.91 0.386 . . . . 0.0 111.123 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -145.15 61.04 1.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.737 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.7 52.47 13.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.149 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.408 ' CD1' ' HG2' ' B' ' 66' ' ' GLN . 6.5 tp -99.43 -41.08 9.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.097 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.407 ' N ' HG23 ' A' ' 71' ' ' ILE . 2.9 t80 -78.57 113.52 35.31 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.836 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.1 134.36 59.73 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.361 2.041 . . . . 0.0 112.255 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.6 mtm180 -156.38 89.01 1.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -73.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -95.51 121.57 37.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.226 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp 53.9 100.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.128 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.623 ' CB ' HD21 ' A' ' 81' ' ' LEU . 13.1 m-20 -75.69 96.3 3.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 28.5 mtt -62.5 -25.82 68.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.901 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.03 -55.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.403 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.711 HD12 HD22 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -81.52 -15.68 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -179.874 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.37 -25.98 38.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.814 0.34 . . . . 0.0 110.744 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.54 -22.86 12.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.89 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.04 -68.46 0.44 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.746 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 p -147.88 -92.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.96 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.711 HD22 HD12 ' A' ' 81' ' ' LEU . 12.8 tp 44.78 29.78 0.47 Allowed 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 120.783 0.325 . . . . 0.0 111.414 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.77 -33.42 1.82 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.361 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.77 -10.29 57.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.668 0.27 . . . . 0.0 111.242 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 21.3 mm -88.71 -53.89 8.76 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.473 ' O ' ' HB ' ' A' ' 94' ' ' THR . 33.2 tt0 -67.49 -16.81 64.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.184 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.825 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -88.02 -47.86 8.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.212 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 10.4 mt -64.08 -24.19 67.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.159 0.504 . . . . 0.0 109.756 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.521 HD13 ' O ' ' A' ' 97' ' ' PHE . 1.3 mm? -91.26 -36.85 13.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.795 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.825 HG22 ' HA ' ' A' ' 91' ' ' ALA . 9.0 t -75.51 -13.02 60.35 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.0 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.65 -31.11 1.86 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.251 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.96 -0.11 12.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 117.151 0.475 . . . . 0.0 112.144 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.542 ' HD2' HG23 ' A' ' 98' ' ' VAL . 0.1 OUTLIER 36.14 -92.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.279 179.485 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.542 HG23 ' HD2' ' A' ' 97' ' ' PHE . 21.6 t . . . . . 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.252 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.843 0.354 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -157.28 27.46 0.3 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.986 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.737 HD22 ' O ' ' B' ' 54' ' ' LEU . 0.0 OUTLIER -101.25 -0.44 35.81 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.605 -179.876 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.522 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -56.33 -53.38 57.94 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.204 0.526 . . . . 0.0 110.778 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.16 -42.13 63.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.662 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.75 HG11 ' HB ' ' A' ' 57' ' ' VAL . 2.9 t -62.65 -40.96 90.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.646 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 2.4 mt-10 -56.66 -64.03 1.0 Allowed 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 43.5 m -52.93 -20.45 3.38 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.138 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.456 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.13 -73.14 0.15 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.156 -179.331 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.883 HD13 HD13 ' B' ' 64' ' ' LEU . 3.6 mm? -61.9 -24.34 66.89 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.2 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -65.5 -37.05 85.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -20.4 53.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.566 178.189 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.883 HD13 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -74.63 -31.95 62.14 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.36 0.6 . . . . 0.0 110.328 179.506 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.583 ' N ' HD23 ' B' ' 64' ' ' LEU . 3.3 mm-40 -92.81 -23.62 18.78 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.718 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 0.408 ' HG2' ' CD1' ' A' ' 71' ' ' ILE . 7.6 mt-30 -58.77 -39.16 80.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.309 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.573 ' O ' HD23 ' B' ' 67' ' ' LEU . 9.2 tt -76.43 -11.41 59.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.025 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' B' ' 67' ' ' LEU . 31.3 t80 76.48 130.99 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.877 0.37 . . . . 0.0 111.216 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.48 60.98 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.0 52.46 12.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.5 tp -99.37 -41.07 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.248 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -78.48 113.54 35.26 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.905 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.05 134.17 58.64 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.416 2.078 . . . . 0.0 112.266 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -155.85 87.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.798 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -163.67 102.33 0.92 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.468 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 66.45 127.08 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.471 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.74 69.56 0.5 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.02 0.438 . . . . 0.0 110.704 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' ASP . . . . . 0.626 ' CB ' HD21 ' B' ' 81' ' ' LEU . 12.9 m-20 -72.02 97.25 1.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.643 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 28.2 mtt -62.64 -25.7 68.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.1 -55.77 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.346 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.626 HD21 ' CB ' ' B' ' 78' ' ' ASP . 0.4 OUTLIER -81.71 -15.53 54.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.484 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.41 -26.01 38.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.788 0.327 . . . . 0.0 110.75 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.53 -22.82 12.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.0 -68.57 0.43 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.715 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 p -147.86 -92.2 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.91 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.507 HD22 HD12 ' B' ' 81' ' ' LEU . 9.1 tp 44.82 29.76 0.48 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.79 0.328 . . . . 0.0 111.358 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.92 -33.35 1.79 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.387 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.72 -10.33 57.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.34 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 20.9 mm -88.48 -53.9 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.456 ' O ' ' HB ' ' B' ' 94' ' ' THR . 33.2 tt0 -67.65 -16.78 64.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.185 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 91' ' ' ALA . . . . . 0.814 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -88.0 -47.73 8.31 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.332 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.21 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.135 0.493 . . . . 0.0 109.713 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.531 HD13 ' O ' ' B' ' 97' ' ' PHE . 1.3 mm? -91.29 -36.95 13.58 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.773 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.814 HG22 ' HA ' ' B' ' 91' ' ' ALA . 9.1 t -75.44 -13.1 60.37 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.033 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.59 -31.04 1.88 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.398 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.9 -0.11 12.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 117.154 0.477 . . . . 0.0 112.273 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.531 ' O ' HD13 ' B' ' 93' ' ' LEU . 0.1 OUTLIER 36.05 -92.87 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.272 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 98' ' ' VAL . . . . . 0.528 HG23 ' HD2' ' B' ' 97' ' ' PHE . 21.5 t . . . . . 0 C--N 1.332 -0.155 0 CA-C-O 120.844 0.354 . . . . 0.0 111.308 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.822 0.344 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.535 ' C ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -144.87 136.97 25.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.034 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.596 HD12 ' N ' ' A' ' 54' ' ' LEU . 5.0 mp -110.5 -57.52 2.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.618 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.423 ' C ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -21.04 -55.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 1.7 mm-40 -58.68 -50.84 72.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.266 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.619 HG12 ' N ' ' B' ' 58' ' ' GLU . 6.1 t -63.92 -53.81 39.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.39 -179.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.786 ' HB2' HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.58 -62.39 1.68 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.576 ' N ' HD22 ' B' ' 61' ' ' LEU . 29.9 t -48.72 -28.03 3.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.64 177.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 8.7 tpt180 -60.74 -63.86 1.15 Allowed 'General case' 0 C--O 1.242 0.694 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.889 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.925 HD23 ' HB2' ' B' ' 62' ' ' GLU . 1.0 OUTLIER -63.03 -18.22 63.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 118.1 -1.44 . . . . 0.0 109.71 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.908 ' HB2' HD23 ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.34 -37.66 87.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.722 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -68.91 -31.6 70.62 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -63.21 -30.15 71.35 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.086 177.67 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.448 ' N ' HD23 ' A' ' 64' ' ' LEU . 0.6 OUTLIER -80.18 -31.44 38.81 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.049 179.159 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -55.74 -35.93 66.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.56 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.01 -29.99 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.524 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.58 102.96 0.78 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.772 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.1 -72.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.26 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.45 ' O ' HG22 ' A' ' 71' ' ' ILE . 4.9 mt -140.48 53.48 1.62 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.85 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 70' ' ' LEU . 7.1 tt 42.84 32.18 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.54 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.15 67.49 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.2 163.91 1.42 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.523 2.149 . . . . 0.0 112.35 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.21 89.34 7.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.404 ' HB3' HD13 ' A' ' 77' ' ' LEU . 4.2 tp10 -159.96 152.08 20.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -80.87 90.18 5.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.404 HD13 ' HB3' ' A' ' 75' ' ' GLU . 6.9 mp -118.91 175.36 5.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.793 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.434 ' HB2' ' HB2' ' A' ' 81' ' ' LEU . 7.0 p-10 -137.08 59.71 1.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -45.92 77.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.015 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -57.16 -39.79 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.861 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.803 HD12 HD12 ' B' ' 81' ' ' LEU . 9.3 mp -71.38 -27.91 63.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.788 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.16 -23.3 44.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 16.4 mtp -95.96 -21.11 18.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.247 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.57 -2.74 37.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.412 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.55 143.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.946 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.531 HD22 HD23 ' A' ' 81' ' ' LEU . 9.7 tp -149.62 26.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.958 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -116.14 -15.96 11.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.287 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.569 ' O ' HD23 ' A' ' 92' ' ' LEU . 67.4 m-20 -71.08 -10.06 59.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.649 0.262 . . . . 0.0 111.22 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.732 ' O ' HD12 ' A' ' 93' ' ' LEU . 20.2 mm -89.68 -55.36 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.501 ' O ' ' HB ' ' A' ' 94' ' ' THR . 20.0 tt0 -66.23 -17.58 64.83 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.275 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.774 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.94 -55.35 3.8 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.555 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.569 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.2 mm? -58.98 -23.44 61.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.115 0.483 . . . . 0.0 110.051 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.732 HD12 ' O ' ' A' ' 89' ' ' ILE . 0.4 OUTLIER -91.43 -40.92 11.15 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.046 179.774 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.774 HG22 ' HA ' ' A' ' 91' ' ' ALA . 10.5 t -71.01 -11.73 61.13 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.226 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.71 -33.64 1.27 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.122 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.01 -2.86 33.4 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.41 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 17.6 p90 40.35 79.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.688 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.109 -179.963 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.745 0.307 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.544 ' C ' HD12 ' B' ' 54' ' ' LEU . 0.0 OUTLIER -144.85 137.02 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.043 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.588 ' N ' HD12 ' B' ' 54' ' ' LEU . 5.0 mp -110.54 -57.51 2.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.641 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.434 ' C ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -20.98 -55.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 179.977 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 1.7 mm-40 -58.7 -50.86 72.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.841 0.353 . . . . 0.0 111.287 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.618 HG12 ' N ' ' A' ' 58' ' ' GLU . 6.1 t -63.8 -53.84 39.43 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.767 ' HB2' HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.56 -62.4 1.68 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.592 ' N ' HD22 ' A' ' 61' ' ' LEU . 30.1 t -48.73 -28.14 3.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.567 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.527 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 8.7 tpt180 -60.6 -63.83 1.16 Allowed 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.991 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.908 HD23 ' HB2' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -63.18 -18.07 63.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.111 -1.436 . . . . 0.0 109.808 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.925 ' HB2' HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -65.38 -37.67 87.71 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 175.616 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -68.96 -31.52 70.45 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.574 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -63.16 -30.29 71.47 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.05 177.653 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.452 ' N ' HD23 ' B' ' 64' ' ' LEU . 0.6 OUTLIER -80.21 -31.32 38.68 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.638 -1.165 . . . . 0.0 110.125 179.147 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -55.86 -35.87 66.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.563 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -29.87 63.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.541 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.64 103.2 0.83 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.647 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 43.7 tp -54.26 -72.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.23 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.441 ' O ' HG22 ' B' ' 71' ' ' ILE . 4.8 mt -140.36 53.46 1.63 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.907 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.441 HG22 ' O ' ' B' ' 70' ' ' LEU . 7.1 tt 42.88 32.1 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.651 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.11 67.58 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.927 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.27 163.92 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.596 2.197 . . . . 0.0 112.28 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.15 89.32 7.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -159.98 151.51 19.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.75 90.07 5.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.58 175.96 5.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' ASP . . . . . 0.429 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 6.9 p-10 -137.33 59.69 1.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.857 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -45.83 77.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.091 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.7 mm -57.14 -39.83 69.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.803 HD12 HD12 ' A' ' 81' ' ' LEU . 9.3 mp -71.32 -27.99 63.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.753 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.1 -23.38 44.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.162 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 16.3 mtp -95.93 -21.13 18.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.186 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.5 -2.83 37.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.378 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.53 144.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.829 0.347 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.434 HD23 ' N ' ' B' ' 86' ' ' LEU . 2.2 pt? -149.8 26.02 0.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.952 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -115.92 -16.13 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.276 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.556 ' O ' HD23 ' B' ' 92' ' ' LEU . 67.7 m-20 -70.99 -10.08 59.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.736 0.303 . . . . 0.0 111.261 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.742 ' O ' HD12 ' B' ' 93' ' ' LEU . 20.1 mm -89.63 -55.42 6.3 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.481 ' O ' ' HB ' ' B' ' 94' ' ' THR . 20.0 tt0 -66.13 -17.78 64.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.217 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 91' ' ' ALA . . . . . 0.794 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.92 -55.33 3.81 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.553 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.556 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.2 mm? -59.05 -23.44 62.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.742 HD12 ' O ' ' B' ' 89' ' ' ILE . 0.4 OUTLIER -91.48 -40.8 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.968 179.811 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.794 HG22 ' HA ' ' B' ' 91' ' ' ALA . 10.6 t -71.16 -11.7 61.08 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.138 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.73 -33.72 1.26 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.756 -0.735 . . . . 0.0 113.044 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.07 -2.8 33.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 117.002 0.401 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.411 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 17.6 p90 40.46 79.55 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.671 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.163 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.757 0.313 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.569 ' HB3' HG22 ' B' ' 57' ' ' VAL . 0.2 OUTLIER -145.49 76.61 1.48 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.096 -179.493 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.452 HD23 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -177.65 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 116.719 -0.218 . . . . 0.0 111.13 -179.623 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.47 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.2 m 24.8 -85.3 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.435 ' CB ' ' CD2' ' B' ' 53' ' ' HIS . 4.0 mm-40 -62.74 -68.03 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.893 0.378 . . . . 0.0 111.744 -178.6 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.562 HG22 ' HB3' ' B' ' 53' ' ' HIS . 1.9 t -55.94 -44.55 78.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.289 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.714 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.1 pt-20 -52.98 -48.19 67.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.452 0.644 . . . . 0.0 109.452 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.48 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 27.8 t -66.39 -20.16 65.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.636 178.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 2.2 tpm_? -70.01 -71.73 0.23 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.832 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.845 ' CD1' HD22 ' A' ' 64' ' ' LEU . 3.5 mm? -61.21 -38.77 87.77 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.245 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.559 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 8.0 tt0 -53.41 -39.44 64.32 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.795 176.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.1 OUTLIER -70.25 -28.54 65.32 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.865 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.845 HD22 ' CD1' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.35 68.92 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.466 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 68' ' ' PHE . 30.0 tt0 -88.63 -25.48 22.4 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.355 178.054 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.27 -76.73 0.06 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.924 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.36 42.09 1.87 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.422 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.563 ' CD2' HD21 ' B' ' 64' ' ' LEU . 31.7 p90 -39.46 104.84 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.988 0.423 . . . . 0.0 111.546 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.91 -66.69 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.789 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 71.3 mt -150.27 -79.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.989 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.92 24.65 4.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.378 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.96 91.02 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.011 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.25 108.51 2.0 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.531 2.154 . . . . 0.0 112.304 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.04 146.89 32.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 55.97 177.72 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.078 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -125.12 37.45 4.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.88 35.38 1.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.856 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.21 20.33 15.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.99 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.15 -28.69 66.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 110.679 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 26.9 mm -79.46 -45.72 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.862 ' HB2' HD23 ' B' ' 81' ' ' LEU . 0.5 OUTLIER -69.43 -24.65 63.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.191 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.27 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.913 0.387 . . . . 0.0 110.891 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 44.4 mtp -57.98 -25.39 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.258 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.03 -59.02 0.45 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.035 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 m 64.53 -163.42 0.26 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.801 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.503 HD23 HD12 ' B' ' 86' ' ' LEU . 1.9 mt 70.41 30.28 3.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.33 -53.07 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.699 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.5 m-20 -70.5 -11.43 60.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.919 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.63 ' O ' HD13 ' A' ' 93' ' ' LEU . 26.4 mm -90.3 -52.06 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.615 ' HA ' HD22 ' B' ' 93' ' ' LEU . 1.5 tt0 -66.02 -17.95 65.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.033 177.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.773 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.89 -53.6 4.67 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.583 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 6.1 mp -61.13 -21.22 63.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.054 0.454 . . . . 0.0 110.156 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.63 HD13 ' O ' ' A' ' 89' ' ' ILE . 7.5 mp -94.52 -38.45 10.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.862 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.773 HG22 ' HA ' ' A' ' 91' ' ' ALA . 12.3 t -72.28 -13.47 61.51 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.909 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.36 -32.32 1.06 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.146 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.472 ' O ' ' CG ' ' A' ' 97' ' ' PHE . 0.4 OUTLIER -115.67 5.59 14.31 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.518 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.472 ' CG ' ' O ' ' A' ' 96' ' ' LEU . 39.0 p90 46.22 -145.21 0.21 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.355 -179.218 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 12.4 p . . . . . 0 C--N 1.327 -0.391 0 CA-C-O 120.855 0.359 . . . . 0.0 111.166 -179.867 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.716 0.293 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.562 ' HB3' HG22 ' A' ' 57' ' ' VAL . 0.2 OUTLIER -145.32 76.71 1.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.989 -179.476 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.457 HD23 ' H ' ' B' ' 55' ' ' THR . 0.5 OUTLIER -177.72 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.151 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.476 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.3 m 24.93 -85.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.44 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 4.0 mm-40 -62.84 -67.97 0.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.873 0.368 . . . . 0.0 111.705 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 53' ' ' HIS . 1.9 t -55.9 -44.71 78.83 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.177 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.702 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.1 pt-20 -52.9 -48.23 67.36 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.429 0.633 . . . . 0.0 109.49 179.122 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.49 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 28.0 t -66.29 -20.24 66.05 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.61 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -69.97 -71.71 0.23 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.891 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.837 ' CD1' HD22 ' B' ' 64' ' ' LEU . 3.5 mm? -61.3 -38.7 87.75 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.427 -0.909 . . . . 0.0 109.169 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.551 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 8.0 tt0 -53.56 -39.32 64.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.765 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 63' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.1 OUTLIER -70.26 -28.59 65.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.837 HD22 ' CD1' ' B' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.43 68.97 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.508 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.449 ' HG2' ' HA ' ' B' ' 68' ' ' PHE . 29.6 tt0 -88.43 -25.65 22.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.45 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -76.83 0.06 Allowed 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.815 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.43 42.21 1.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.35 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.556 ' CD2' HD21 ' A' ' 64' ' ' LEU . 31.8 p90 -39.43 104.73 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.859 0.361 . . . . 0.0 111.593 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.744 HD23 ' HG ' ' B' ' 70' ' ' LEU . 8.0 tt -145.91 -66.32 0.3 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.891 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.744 ' HG ' HD23 ' B' ' 69' ' ' LEU . 71.7 mt -150.49 -79.43 0.12 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.88 24.6 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.316 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.98 90.96 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.007 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -69.36 108.57 2.03 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.358 2.039 . . . . 0.0 112.273 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.98 146.92 32.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.963 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -57.95 88.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 p30 -131.07 23.38 4.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.82 89.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.227 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -113.9 20.09 16.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.83 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.2 -28.74 66.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.657 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 26.6 mm -79.28 -45.94 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.858 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.862 HD23 ' HB2' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -69.26 -24.66 64.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.29 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.24 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 44.6 mtp -57.94 -25.47 60.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.226 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.05 -59.11 0.45 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.781 0.324 . . . . 0.0 111.019 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 m 64.68 -163.48 0.26 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.829 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.503 HD12 HD23 ' A' ' 86' ' ' LEU . 0.4 OUTLIER 70.34 30.21 3.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.08 -53.04 0.91 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.728 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.5 m-20 -70.56 -11.42 60.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.881 0.372 . . . . 0.0 110.934 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.635 ' O ' HD13 ' B' ' 93' ' ' LEU . 26.5 mm -90.3 -52.0 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.606 ' HA ' HD22 ' A' ' 93' ' ' LEU . 1.5 tt0 -66.02 -17.87 64.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.086 177.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 91' ' ' ALA . . . . . 0.81 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.92 -53.66 4.63 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.588 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 6.1 mp -61.02 -21.35 63.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.423 . . . . 0.0 110.0 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.635 HD13 ' O ' ' B' ' 89' ' ' ILE . 7.5 mp -94.62 -38.33 10.9 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.81 HG22 ' HA ' ' B' ' 91' ' ' ALA . 12.4 t -72.29 -13.43 61.5 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.889 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.32 -32.36 1.06 Allowed Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.151 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.478 ' O ' ' CG ' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -115.64 5.59 14.34 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.478 ' CG ' ' O ' ' B' ' 96' ' ' LEU . 39.0 p90 46.34 -145.28 0.22 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.327 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 120.814 0.34 . . . . 0.0 111.22 -179.978 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.871 0.367 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.451 ' ND1' ' CE1' ' B' ' 53' ' ' HIS . 0.1 OUTLIER -62.06 83.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.454 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.93 HD12 HG22 ' B' ' 57' ' ' VAL . 2.3 tp 179.79 -33.55 0.01 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.656 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.568 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 5.1 m -45.23 -80.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -35.02 -65.44 0.22 Allowed 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.944 HG22 HD12 ' B' ' 54' ' ' LEU . 4.3 t -52.86 -28.99 14.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.234 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.673 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.7 pt-20 -64.92 -48.75 73.02 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.424 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 53.1 p -64.54 -18.61 64.99 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.501 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.501 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -75.61 0.12 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.078 -179.709 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.846 HD13 HD22 ' A' ' 64' ' ' LEU . 3.6 mm? -59.97 -29.72 68.62 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.032 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.677 ' HB2' HD12 ' B' ' 61' ' ' LEU . 19.6 tt0 -62.89 -39.5 94.7 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.081 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.56 -15.55 58.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.754 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.846 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -85.64 -24.28 27.16 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.421 -179.547 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.511 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -104.46 -21.9 13.39 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.78 -179.573 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.595 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -84.43 2.01 42.71 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.264 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.46 HD23 ' CD2' ' A' ' 68' ' ' PHE . 6.0 tp -114.09 -35.13 5.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 110.916 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.46 ' CD2' HD23 ' A' ' 67' ' ' LEU . 46.9 m-85 -141.61 166.91 23.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.971 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.9 mt 58.95 55.73 4.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.053 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.595 HD11 ' HA ' ' A' ' 66' ' ' GLN . 10.0 mt -129.19 -85.36 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.56 17.38 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.605 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.82 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.886 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.83 118.0 5.21 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.402 2.068 . . . . 0.0 112.339 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -161.86 162.27 29.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.808 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -144.54 133.21 22.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.915 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -177.64 -46.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.887 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 64.32 126.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.055 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.18 46.48 7.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.017 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 27.8 mtp -70.07 -41.18 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.749 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.945 HG22 HD23 ' B' ' 81' ' ' LEU . 12.5 mm -63.5 -51.33 71.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.834 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 1.075 HD22 HD22 ' B' ' 81' ' ' LEU . 0.9 OUTLIER -66.14 -29.03 69.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.854 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.9 -30.0 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.992 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.3 -21.6 24.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.05 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.83 102.72 15.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.901 0.382 . . . . 0.0 110.78 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.59 87.03 1.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.698 ' HB3' HD23 ' B' ' 86' ' ' LEU . 0.4 OUTLIER -114.48 -17.98 11.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -71.4 -8.89 56.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.526 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 68.3 m-20 -73.1 -9.85 59.17 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.798 0.333 . . . . 0.0 110.995 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.554 HG22 HG22 ' B' ' 89' ' ' ILE . 7.4 mm -88.6 -53.0 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 94' ' ' THR . 1.6 tt0 -67.02 -20.7 65.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.911 178.013 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.25 -67.43 0.8 Allowed 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.409 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.534 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.1 tt -52.05 -23.74 5.69 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.02 0.438 . . . . 0.0 110.389 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.903 HD12 HD12 ' B' ' 93' ' ' LEU . 8.1 tt -87.77 -38.43 15.77 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.532 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.405 ' CB ' ' O ' ' A' ' 90' ' ' GLU . 3.8 m -72.76 -10.89 60.32 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.87 -30.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.477 -0.868 . . . . 0.0 113.788 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.06 4.88 3.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 93' ' ' LEU . 22.7 p90 40.3 70.57 0.23 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.575 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.844 ' HB ' HD11 ' B' ' 93' ' ' LEU . 13.8 p . . . . . 0 C--O 1.233 0.212 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.863 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.88 0.371 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.451 ' CE1' ' ND1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -62.04 83.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.53 179.667 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.944 HD12 HG22 ' A' ' 57' ' ' VAL . 2.3 tp 179.84 -33.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.755 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.569 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 5.0 m -45.15 -80.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -34.91 -65.53 0.21 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.93 HG22 HD12 ' A' ' 54' ' ' LEU . 4.3 t -52.88 -28.94 14.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.165 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.656 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.7 pt-20 -64.98 -48.62 73.34 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 53.0 p -64.67 -18.55 65.08 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.512 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -75.54 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.067 -179.744 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.854 HD13 HD22 ' B' ' 64' ' ' LEU . 3.6 mm? -60.02 -29.71 68.68 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.948 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.658 ' HB2' HD12 ' A' ' 61' ' ' LEU . 19.6 tt0 -62.79 -39.67 94.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.132 177.498 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.54 -15.48 58.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.716 178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.854 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -85.68 -24.4 27.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.906 0.384 . . . . 0.0 111.339 -179.591 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.517 ' O ' HD11 ' B' ' 70' ' ' LEU . 0.1 OUTLIER -104.47 -21.83 13.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 0.611 ' HA ' HD11 ' B' ' 70' ' ' LEU . 0.0 OUTLIER -84.53 2.2 42.27 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.298 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.465 HD23 ' CD2' ' B' ' 68' ' ' PHE . 6.0 tp -114.07 -35.18 5.14 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.833 0.349 . . . . 0.0 110.95 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.465 ' CD2' HD23 ' B' ' 67' ' ' LEU . 46.7 m-85 -141.58 166.9 23.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.035 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 mp 58.95 55.56 4.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.093 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.611 HD11 ' HA ' ' B' ' 66' ' ' GLN . 10.0 mt -128.98 -85.41 0.56 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.817 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.57 17.5 4.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.586 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.93 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.726 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.85 117.87 5.11 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.508 2.139 . . . . 0.0 112.349 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -161.31 160.39 29.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.826 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -119.44 -165.17 1.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.922 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.59 101.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.77 164.15 18.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.77 46.49 8.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.816 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 27.9 mtp -69.92 -41.28 74.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.719 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.903 HG22 HD23 ' A' ' 81' ' ' LEU . 12.4 mm -63.44 -51.35 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 1.075 HD22 HD22 ' A' ' 81' ' ' LEU . 0.9 OUTLIER -66.17 -28.95 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.873 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.85 -30.18 62.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.972 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.24 -21.59 24.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.064 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.78 102.8 15.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.865 0.364 . . . . 0.0 110.744 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.69 87.12 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.01 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.698 HD23 ' HB3' ' A' ' 86' ' ' LEU . 1.9 mp -114.41 -18.19 11.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.269 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -71.36 -8.82 56.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.523 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 68.4 m-20 -73.02 -9.97 59.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.803 0.335 . . . . 0.0 111.04 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.554 HG22 HG22 ' A' ' 89' ' ' ILE . 7.4 mm -88.64 -53.03 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.401 ' O ' ' CB ' ' B' ' 94' ' ' THR . 1.6 tt0 -66.96 -20.71 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.947 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.18 -67.44 0.79 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.529 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.537 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.1 tt -51.96 -23.91 5.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.979 0.419 . . . . 0.0 110.309 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.903 HD12 HD12 ' A' ' 93' ' ' LEU . 8.1 tt -87.72 -38.38 15.86 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.554 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.401 ' CB ' ' O ' ' B' ' 90' ' ' GLU . 3.8 m -72.73 -10.91 60.35 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.155 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.92 -30.23 1.66 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.433 -0.889 . . . . 0.0 113.645 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.09 4.97 3.01 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' B' ' 93' ' ' LEU . 22.8 p90 40.26 70.48 0.24 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.878 0.37 . . . . 0.0 111.618 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 98' ' ' VAL . . . . . 0.851 ' HB ' HD11 ' A' ' 93' ' ' LEU . 13.7 p . . . . . 0 CA--C 1.53 0.193 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.81 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.828 0.347 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 179.05 57.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.634 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.665 ' CD2' HG13 ' B' ' 57' ' ' VAL . 0.3 OUTLIER -136.35 -51.49 0.7 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.873 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 54' ' ' LEU . 92.3 m 15.2 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.477 ' N ' ' O ' ' A' ' 54' ' ' LEU . 8.4 pt-20 -64.96 -55.95 16.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.632 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.739 ' HB ' HG11 ' B' ' 57' ' ' VAL . 4.6 t -59.6 -50.0 81.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-O 120.524 0.202 . . . . 0.0 111.454 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.782 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -53.11 -49.67 66.03 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.5 t -61.65 -21.43 64.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.589 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.454 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 0.7 OUTLIER -71.26 -73.17 0.19 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.311 -179.337 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.773 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -60.85 -27.1 67.85 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.129 -178.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.473 ' HB2' HD12 ' B' ' 61' ' ' LEU . 1.8 tt0 -66.83 -38.81 87.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.376 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.762 ' HG2' HD21 ' A' ' 67' ' ' LEU . 45.2 ttp180 -83.54 -9.18 59.11 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.78 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.953 HD22 ' O ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -91.83 -27.41 17.98 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.03 0.443 . . . . 0.0 111.254 -179.079 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.841 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 1.4 tp10 -113.5 -48.3 2.95 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 8.4 tt0 -47.0 -43.82 19.71 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.762 HD21 ' HG2' ' A' ' 63' ' ' ARG . 3.3 pp -97.49 22.7 8.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.775 0.321 . . . . 0.0 111.038 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -135.65 96.3 3.42 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 110.649 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.998 HD21 HD23 ' B' ' 69' ' ' LEU . 0.2 OUTLIER -154.97 158.7 39.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.619 -179.649 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.752 ' H ' HD13 ' A' ' 69' ' ' LEU . 31.3 mt -49.74 -28.18 5.8 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.826 0.345 . . . . 0.0 111.064 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 34.1 mm -67.32 -14.33 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.275 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.21 106.12 0.59 Allowed Pre-proline 0 C--N 1.332 -0.183 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.8 127.0 13.93 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.403 2.069 . . . . 0.0 112.336 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.27 -40.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.864 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -131.49 177.28 7.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -110.78 75.91 0.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.014 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.25 -39.66 62.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.77 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.537 ' CB ' HD21 ' A' ' 81' ' ' LEU . 50.4 m-20 -146.69 93.77 2.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.868 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.16 -24.48 64.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.081 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.0 mm -63.31 -56.3 18.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.365 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.537 HD21 ' CB ' ' A' ' 78' ' ' ASP . 0.4 OUTLIER -82.89 -10.45 58.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.599 -179.657 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -88.19 -27.3 21.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.55 0.214 . . . . 0.0 111.263 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -16.25 12.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.536 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.57 -66.3 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.795 0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.59 -171.32 0.19 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.187 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -168.08 -43.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.786 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.876 ' CB ' ' HB2' ' A' ' 91' ' ' ALA . 38.1 mtt180 -107.89 -67.94 0.93 Allowed 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.826 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.6 m-20 21.53 -59.39 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.873 ' N ' ' O ' ' A' ' 87' ' ' ARG . 19.9 mm -84.27 -58.24 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 94' ' ' THR . 3.4 tm-20 -66.13 -12.06 53.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.347 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.876 ' HB2' ' CB ' ' A' ' 87' ' ' ARG . . . -87.22 -57.09 3.09 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.172 0.511 . . . . 0.0 110.054 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 0.1 OUTLIER -60.26 -21.28 61.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.869 178.884 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.676 HD23 ' O ' ' A' ' 97' ' ' PHE . 5.1 mt -93.34 -35.43 13.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.736 HG22 ' HA ' ' A' ' 91' ' ' ALA . 12.8 t -75.61 -12.26 60.18 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.66 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.03 -29.44 1.81 Allowed Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.206 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.61 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -118.88 2.17 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.441 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.676 ' O ' HD23 ' A' ' 93' ' ' LEU . 0.1 OUTLIER 37.67 -93.1 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.167 179.638 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.457 ' O ' HD23 ' A' ' 96' ' ' LEU . 20.1 t . . . . . 0 C--N 1.33 -0.269 0 CA-C-O 120.779 0.323 . . . . 0.0 111.238 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.812 0.339 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 179.02 57.45 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.683 ' CD2' HG13 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -136.24 -51.47 0.71 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.9 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.449 ' C ' ' O ' ' B' ' 54' ' ' LEU . 92.2 m 15.16 -79.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' B' ' 54' ' ' LEU . 8.4 pt-20 -65.06 -55.85 16.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.601 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.739 HG11 ' HB ' ' A' ' 57' ' ' VAL . 4.5 t -59.59 -50.0 81.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-O 120.538 0.208 . . . . 0.0 111.461 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.773 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -53.06 -49.68 65.87 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.347 0.594 . . . . 0.0 109.522 179.073 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 12.4 t -61.8 -21.34 64.51 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.511 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.442 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 0.7 OUTLIER -71.38 -73.2 0.19 Allowed 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.417 -0.811 . . . . 0.0 112.267 -179.301 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.782 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -60.84 -26.91 67.69 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.207 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' B' ' 66' ' ' GLN . 1.8 tt0 -66.89 -38.82 86.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.317 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 63' ' ' ARG . . . . . 0.782 ' HG2' HD21 ' B' ' 67' ' ' LEU . 45.0 ttp180 -83.43 -9.35 59.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.808 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.972 ' O ' HD22 ' B' ' 64' ' ' LEU . 0.0 OUTLIER -91.82 -27.42 17.99 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.01 0.433 . . . . 0.0 111.271 -179.032 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.841 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.4 tp10 -113.53 -48.24 2.95 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 66' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' B' ' 62' ' ' GLU . 8.4 tt0 -46.99 -43.69 19.55 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.782 HD21 ' HG2' ' B' ' 63' ' ' ARG . 3.3 pp -97.56 22.71 8.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.724 0.297 . . . . 0.0 111.003 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -135.6 97.15 3.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.861 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.998 HD23 HD21 ' A' ' 69' ' ' LEU . 0.3 OUTLIER -156.12 160.93 40.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.814 179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 31.9 mt -51.12 -28.46 10.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.695 ' HB ' HD13 ' B' ' 69' ' ' LEU . 33.9 mm -67.34 -14.17 17.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.391 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.18 106.02 0.57 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.236 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.66 127.05 14.11 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.41 2.074 . . . . 0.0 112.387 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.16 -39.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.855 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.99 -176.32 3.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -78.52 -69.92 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.94 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.6 mt 68.82 -68.1 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 78' ' ' ASP . . . . . 0.541 ' CB ' HD21 ' B' ' 81' ' ' LEU . 50.3 m-20 -147.19 94.05 2.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.25 -24.51 64.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.09 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 39.3 mm -63.38 -56.17 18.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.315 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.541 HD21 ' CB ' ' B' ' 78' ' ' ASP . 0.4 OUTLIER -82.97 -10.5 58.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.689 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -88.07 -27.33 22.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.685 0.279 . . . . 0.0 111.404 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.51 -16.18 12.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.621 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.5 -66.36 0.29 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.777 0.322 . . . . 0.0 111.012 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.7 -171.26 0.19 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.974 0.416 . . . . 0.0 111.026 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -168.15 -43.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.763 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.877 ' CB ' ' HB2' ' B' ' 91' ' ' ALA . 38.7 mtt180 -108.23 -67.9 0.94 Allowed 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.769 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.6 m-20 21.71 -59.54 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.872 ' N ' ' O ' ' B' ' 87' ' ' ARG . 20.4 mm -84.33 -58.22 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.507 ' O ' ' HB ' ' B' ' 94' ' ' THR . 3.4 tm-20 -66.0 -12.19 53.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.392 177.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 91' ' ' ALA . . . . . 0.877 ' HB2' ' CB ' ' B' ' 87' ' ' ARG . . . -87.15 -57.03 3.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.138 0.494 . . . . 0.0 110.084 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.422 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 0.1 OUTLIER -60.15 -21.29 61.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.985 178.78 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.675 HD23 ' O ' ' B' ' 97' ' ' PHE . 5.1 mt -93.32 -35.52 13.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.929 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.713 HG22 ' HA ' ' B' ' 91' ' ' ALA . 12.6 t -75.53 -12.26 60.19 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.752 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.04 -29.55 1.78 Allowed Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.722 -0.752 . . . . 0.0 113.137 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.62 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.6 OUTLIER -118.78 2.16 11.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.492 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.675 ' O ' HD23 ' B' ' 93' ' ' LEU . 0.1 OUTLIER 37.78 -93.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.022 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 98' ' ' VAL . . . . . 0.461 ' O ' HD23 ' B' ' 96' ' ' LEU . 20.0 t . . . . . 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 0.0 111.27 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.584 0.23 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 59.76 111.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.875 0.369 . . . . 0.0 110.889 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.964 HD23 HG22 ' B' ' 57' ' ' VAL . 1.3 mt -119.15 -17.15 9.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.811 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.521 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 92.7 m -53.6 -84.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.29 -60.93 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.951 HG22 HD23 ' B' ' 54' ' ' LEU . 3.3 t -56.73 -39.33 63.06 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 120.918 0.389 . . . . 0.0 111.842 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.81 ' O ' HD13 ' B' ' 61' ' ' LEU . 1.3 pt-20 -58.52 -55.06 39.96 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.478 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 31.4 t -63.53 -14.91 55.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.623 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.523 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 1.7 ttt180 -70.83 -74.03 0.16 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.493 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 1.11 HD23 HD22 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -66.17 -20.02 66.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 117.772 -1.571 . . . . 0.0 109.702 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.943 ' CB ' HD22 ' B' ' 61' ' ' LEU . 11.0 tm-20 -64.4 -38.5 91.25 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 175.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -70.91 -29.35 65.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.863 177.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 1.11 HD22 HD23 ' A' ' 61' ' ' LEU . 0.1 OUTLIER -67.47 -28.39 67.82 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.804 178.411 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -83.71 -31.28 26.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.249 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -29.08 68.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.28 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' A' ' 68' ' ' PHE . 7.3 mt -84.06 -12.18 55.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.019 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.464 ' CE1' ' CG2' ' A' ' 71' ' ' ILE . 83.8 t80 65.54 95.22 0.06 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.873 0.368 . . . . 0.0 110.775 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.497 HD13 ' H ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -155.22 157.42 37.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.967 -179.936 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.497 ' H ' HD13 ' A' ' 69' ' ' LEU . 1.0 OUTLIER 54.08 21.65 3.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.68 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.614 HD13 ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -120.96 -48.61 2.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.672 0.273 . . . . 0.0 110.827 179.715 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.496 ' N ' HG23 ' A' ' 71' ' ' ILE . 4.6 m-85 55.84 165.57 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.861 0.363 . . . . 0.0 111.262 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -78.19 126.07 7.53 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.642 2.228 . . . . 0.0 112.263 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.06 -30.58 11.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.993 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -91.98 166.71 12.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.949 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.466 ' OD1' HG23 ' B' ' 80' ' ' ILE . 19.0 t70 -107.82 -43.12 4.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 mp 63.49 140.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.574 ' HA ' HD21 ' A' ' 81' ' ' LEU . 1.5 t0 -109.84 -26.29 9.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.46 -29.1 61.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.073 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -65.14 -66.47 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.881 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.824 ' O ' HD13 ' A' ' 86' ' ' LEU . 0.6 OUTLIER -60.22 -19.35 54.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 179.935 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -81.23 -31.53 33.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.802 0.334 . . . . 0.0 111.027 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.4 ptm -92.6 -13.44 29.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.573 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.18 51.73 2.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 111.423 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.0 m 44.92 93.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.573 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.824 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -115.9 -28.67 6.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.166 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.34 -11.5 59.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.494 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.547 ' O ' HD12 ' A' ' 92' ' ' LEU . 3.2 m-20 -71.48 -10.43 59.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.718 0.294 . . . . 0.0 111.295 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.8 mm -89.58 -55.52 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.42 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.545 ' HG3' HD11 ' B' ' 93' ' ' LEU . 38.1 tt0 -66.32 -17.91 65.04 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.303 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.83 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -88.24 -53.42 4.71 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.453 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.547 HD12 ' O ' ' A' ' 88' ' ' ASP . 16.8 mt -58.76 -25.22 62.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.973 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.548 HD11 ' HG3' ' B' ' 90' ' ' GLU . 0.8 OUTLIER -91.99 -39.38 11.7 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.067 179.845 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.83 HG22 ' HA ' ' A' ' 91' ' ' ALA . 10.7 t -70.94 -11.78 61.16 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.008 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.76 -34.76 1.23 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.958 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.402 ' C ' ' CD1' ' A' ' 97' ' ' PHE . 0.1 OUTLIER -98.36 -2.27 39.68 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.945 0.372 . . . . 0.0 111.914 -179.672 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.402 ' CD1' ' C ' ' A' ' 96' ' ' LEU . 3.4 p90 40.5 -125.94 0.45 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.277 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.332 -0.159 0 CA-C-O 120.803 0.335 . . . . 0.0 111.229 -179.928 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.706 0.289 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 59.93 111.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.867 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.951 HD23 HG22 ' A' ' 57' ' ' VAL . 1.3 mt -119.21 -17.29 8.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.796 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.524 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 92.5 m -53.53 -84.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.32 -60.97 0.17 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.964 HG22 HD23 ' A' ' 54' ' ' LEU . 3.2 t -56.62 -39.33 62.16 Favored 'Isoleucine or valine' 0 C--O 1.25 1.08 0 CA-C-O 120.939 0.399 . . . . 0.0 111.93 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.809 ' O ' HD13 ' A' ' 61' ' ' LEU . 1.2 pt-20 -58.58 -55.06 39.89 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.485 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 31.2 t -63.49 -15.01 56.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.618 177.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.517 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 1.7 ttt180 -70.62 -74.19 0.15 Allowed 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.495 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 1.046 HD23 HD22 ' B' ' 64' ' ' LEU . 0.1 OUTLIER -66.15 -19.97 66.0 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 117.703 -1.599 . . . . 0.0 109.651 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.969 ' HB2' HD22 ' A' ' 61' ' ' LEU . 11.1 tm-20 -64.45 -38.5 91.23 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -70.92 -29.21 65.19 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.909 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 1.046 HD22 HD23 ' B' ' 61' ' ' LEU . 0.1 OUTLIER -67.54 -28.46 67.83 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.697 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -83.71 -31.35 26.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.093 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -29.09 68.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.262 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' B' ' 68' ' ' PHE . 7.3 mt -83.95 -12.18 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.657 ' O ' HD22 ' B' ' 69' ' ' LEU . 83.7 t80 65.58 95.14 0.06 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.801 0.334 . . . . 0.0 110.713 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.657 HD22 ' O ' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -155.25 157.32 37.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 54.15 21.78 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.588 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.609 HD13 ' O ' ' B' ' 71' ' ' ILE . 0.0 OUTLIER -120.97 -48.64 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.611 0.243 . . . . 0.0 110.839 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 72' ' ' PHE . . . . . 0.49 ' N ' HG23 ' B' ' 71' ' ' ILE . 4.6 m-85 55.77 165.66 0.06 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.277 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.34 126.16 7.47 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.541 2.161 . . . . 0.0 112.268 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.05 -30.63 11.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.997 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -92.1 167.24 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -108.26 -42.96 4.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.926 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.2 mt 63.52 140.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.985 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 78' ' ' ASP . . . . . 0.574 ' HA ' HD21 ' B' ' 81' ' ' LEU . 1.5 t0 -109.89 -26.28 9.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -29.21 61.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.016 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.466 HG23 ' OD1' ' A' ' 76' ' ' ASP . 35.6 mm -64.98 -66.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.973 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.574 HD21 ' HA ' ' B' ' 78' ' ' ASP . 0.6 OUTLIER -60.3 -19.39 54.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.135 179.925 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -80.96 -31.69 34.77 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.823 0.344 . . . . 0.0 111.121 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 25.5 ptm -92.63 -13.38 29.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.568 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.25 51.75 2.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.781 0.324 . . . . 0.0 111.39 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 6.1 m 45.01 93.05 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.484 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tp -115.82 -28.79 6.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.044 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.36 -11.41 59.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.548 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.548 ' O ' HD12 ' B' ' 92' ' ' LEU . 3.1 m-20 -71.51 -10.43 59.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 0.0 111.309 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 17.2 mm -89.66 -55.59 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.454 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.548 ' HG3' HD11 ' A' ' 93' ' ' LEU . 38.2 tt0 -66.11 -18.05 65.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.278 177.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 91' ' ' ALA . . . . . 0.814 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -88.23 -53.39 4.72 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.507 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.548 HD12 ' O ' ' B' ' 88' ' ' ASP . 16.8 mt -58.77 -25.19 62.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.076 0.465 . . . . 0.0 110.083 178.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.545 HD11 ' HG3' ' A' ' 90' ' ' GLU . 0.8 OUTLIER -91.93 -39.45 11.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.117 179.778 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.814 HG22 ' HA ' ' B' ' 91' ' ' ALA . 10.8 t -70.91 -11.88 61.22 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.942 179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.67 -34.73 1.24 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.002 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.406 ' C ' ' CD1' ' B' ' 97' ' ' PHE . 0.1 OUTLIER -98.44 -2.09 39.85 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.758 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' B' ' 96' ' ' LEU . 3.4 p90 40.54 -125.93 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.304 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.332 -0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.998 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.445 ' O ' ' CG ' ' A' ' 53' ' ' HIS . . . . . . . . 0 CA--C 1.533 0.321 0 N-CA-C 110.905 -0.035 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 52' ' ' ALA . 21.2 p80 43.58 30.06 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.753 0.311 . . . . 0.0 111.456 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.67 -32.59 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 1.7 m -75.59 -41.25 55.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.441 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.8 -40.97 63.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.928 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.578 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 2.8 t -71.89 -40.94 69.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 120.975 0.417 . . . . 0.0 110.839 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.774 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 24.5 pt-20 -62.63 -48.15 80.64 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.434 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 3.5 m -63.42 -22.67 67.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.309 177.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 2.7 mtt-85 -68.54 -71.68 0.21 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.671 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.0 mm? -61.37 -24.79 66.73 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.844 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.493 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.05 -37.02 86.21 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.69 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -31.13 68.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.866 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.518 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -68.48 -27.77 66.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.293 178.369 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.47 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 2.2 tm-20 -80.88 -31.58 35.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.473 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.02 -49.47 65.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.76 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.659 HD12 ' O ' ' A' ' 68' ' ' PHE . 3.7 pp -63.0 -26.98 69.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.916 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.659 ' O ' HD12 ' A' ' 67' ' ' LEU . 2.1 m-85 64.68 160.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.934 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.94 88.22 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.795 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 51.57 51.67 16.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 1.044 HD11 HD11 ' B' ' 71' ' ' ILE . 0.5 OUTLIER 41.82 31.35 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.897 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.435 ' HB2' ' CZ ' ' B' ' 68' ' ' PHE . 10.9 t80 68.31 100.96 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.62 -174.87 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.684 2.256 . . . . 0.0 112.169 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 66.5 -73.88 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.9 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 66.79 6.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.653 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.64 -46.28 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.028 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 tp 60.78 159.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.722 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.649 ' HA ' HD21 ' A' ' 81' ' ' LEU . 5.7 p-10 -136.06 19.81 3.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.168 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -35.4 63.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.833 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.859 HG12 HD13 ' B' ' 71' ' ' ILE . 3.2 mp -64.01 -46.02 95.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' A' ' 78' ' ' ASP . 0.3 OUTLIER -77.08 -27.88 54.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.895 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -27.84 62.55 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.81 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' MET . . . . . 0.409 ' HE3' ' HA ' ' A' ' 80' ' ' ILE . 13.5 ptp -95.64 -25.04 16.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.094 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.59 -50.45 9.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.693 ' OG ' HD21 ' B' ' 86' ' ' LEU . 13.7 p -178.93 130.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.977 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -175.89 -57.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.807 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -80.11 -28.45 38.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.789 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -72.75 -9.41 58.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.849 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.448 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 17.4 mm -89.66 -54.74 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -64.51 -21.11 66.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.197 177.799 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.752 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -86.42 -67.34 0.82 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.717 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 96' ' ' LEU . 71.6 mt -49.01 -26.61 2.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.063 0.459 . . . . 0.0 110.413 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.829 HD12 HD12 ' B' ' 93' ' ' LEU . 1.0 OUTLIER -87.87 -44.01 11.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.978 179.672 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.752 HG22 ' HA ' ' A' ' 91' ' ' ALA . 9.8 t -67.79 -8.27 34.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.583 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.71 -29.73 1.65 Allowed Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.022 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.2 OUTLIER -100.43 -1.65 35.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.864 0.364 . . . . 0.0 111.96 -179.609 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.663 ' O ' HG12 ' A' ' 98' ' ' VAL . 73.9 t80 -65.85 -57.4 8.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.625 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 97' ' ' PHE . 9.9 p . . . . . 0 CA--C 1.53 0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.139 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 52' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' B' ' 53' ' ' HIS . . . . . . . . 0 CA--C 1.533 0.319 0 N-CA-C 110.953 -0.017 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.437 ' CG ' ' O ' ' B' ' 52' ' ' ALA . 21.3 p80 43.65 29.98 0.32 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.825 0.345 . . . . 0.0 111.535 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.65 -32.6 0.69 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.425 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 1.8 m -75.66 -41.23 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.75 -41.01 63.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.922 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.577 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 2.8 t -71.92 -40.83 68.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.083 0.468 . . . . 0.0 110.888 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.762 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.5 pt-20 -62.8 -47.98 81.11 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.433 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 3.5 m -63.52 -22.61 66.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.347 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.577 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 2.7 mtt-85 -68.47 -71.65 0.21 Allowed 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.791 -179.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.0 mm? -61.27 -24.91 66.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 119.173 -1.011 . . . . 0.0 109.858 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.49 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -64.96 -37.2 86.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.713 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -31.13 69.03 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.033 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.532 ' HA ' HD21 ' B' ' 67' ' ' LEU . 0.3 OUTLIER -68.37 -27.81 66.57 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.349 178.29 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.47 ' HB2' ' HB2' ' A' ' 65' ' ' GLU . 2.2 tm-20 -80.97 -31.48 34.78 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.414 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -49.58 64.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.795 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.662 HD12 ' O ' ' B' ' 68' ' ' PHE . 3.7 pp -62.89 -27.0 69.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.939 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.662 ' O ' HD12 ' B' ' 67' ' ' LEU . 2.1 m-85 64.64 160.53 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.634 ' O ' HD23 ' B' ' 69' ' ' LEU . 10.2 tt -143.75 88.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.792 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 51.39 51.72 16.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.076 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 1.044 HD11 HD11 ' A' ' 71' ' ' ILE . 0.5 OUTLIER 41.83 31.34 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.869 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 72' ' ' PHE . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 68' ' ' PHE . 10.9 t80 68.32 100.78 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.062 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.45 -174.76 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.638 2.226 . . . . 0.0 112.236 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 66.36 -74.37 0.06 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.051 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.82 -69.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.944 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -66.86 0.24 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp 60.03 166.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.952 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 78' ' ' ASP . . . . . 0.637 ' HA ' HD21 ' B' ' 81' ' ' LEU . 5.6 p-10 -136.15 19.87 3.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.088 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -35.42 63.24 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.864 0.364 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.855 HG12 HD13 ' A' ' 71' ' ' ILE . 3.2 mp -64.06 -45.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.907 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.637 HD21 ' HA ' ' B' ' 78' ' ' ASP . 0.3 OUTLIER -77.26 -27.89 53.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.777 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -27.79 62.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.814 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 13.5 ptp -95.64 -25.07 16.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.023 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.57 -50.42 10.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.974 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 13.7 p -178.91 130.12 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.828 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.693 HD21 ' OG ' ' A' ' 85' ' ' SER . 0.2 OUTLIER -175.91 -57.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.827 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -80.25 -28.43 38.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.758 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.65 -9.45 58.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.843 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.443 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 17.0 mm -89.56 -54.75 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 94' ' ' THR . 0.0 OUTLIER -64.48 -21.18 66.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.191 177.787 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 91' ' ' ALA . . . . . 0.754 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -86.48 -67.22 0.83 Allowed 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.733 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.424 ' O ' ' HB2' ' B' ' 96' ' ' LEU . 71.5 mt -49.06 -26.65 2.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.13 0.491 . . . . 0.0 110.399 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.829 HD12 HD12 ' A' ' 93' ' ' LEU . 1.0 OUTLIER -87.77 -44.15 11.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.007 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.754 HG22 ' HA ' ' B' ' 91' ' ' ALA . 9.7 t -67.75 -8.2 33.62 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.549 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.72 -29.74 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.62 -0.8 . . . . 0.0 113.062 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.432 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -100.45 -1.65 35.27 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.963 0.381 . . . . 0.0 111.936 -179.663 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.678 ' O ' HG12 ' B' ' 98' ' ' VAL . 74.4 t80 -65.82 -57.38 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.681 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 98' ' ' VAL . . . . . 0.678 HG12 ' O ' ' B' ' 97' ' ' PHE . 10.0 p . . . . . 0 CA--C 1.53 0.191 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.151 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.901 0.381 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.7 p-80 -134.24 147.25 50.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.828 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.619 HD23 HG22 ' B' ' 57' ' ' VAL . 0.5 OUTLIER -136.31 -53.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.575 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.1 m 21.5 -86.31 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -68.31 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.974 0.416 . . . . 0.0 111.324 -179.251 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.615 ' HA ' ' HB2' ' A' ' 60' ' ' ARG . 22.6 t -53.82 -27.97 16.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.726 -179.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.718 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -66.55 -46.8 74.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.189 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.406 ' N ' ' HG2' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -68.02 -17.33 64.38 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.381 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.615 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -73.72 0.17 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.663 -179.805 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.826 HD13 HD22 ' A' ' 64' ' ' LEU . 4.1 mm? -62.35 -32.35 73.12 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.69 -179.364 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.687 ' HB2' HD12 ' B' ' 61' ' ' LEU . 3.4 tt0 -61.29 -36.31 79.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.199 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -81.09 -16.1 54.09 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.989 0.423 . . . . 0.0 110.023 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.983 HD23 ' HG2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -79.12 -27.19 42.83 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.376 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.983 ' HG2' HD23 ' A' ' 64' ' ' LEU . 7.6 mm-40 -102.86 -21.6 13.99 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.125 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.61 -36.07 83.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.962 0.411 . . . . 0.0 110.171 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 69' ' ' LEU . 0.2 OUTLIER -83.27 -0.35 49.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.742 179.384 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 73.1 m-85 67.4 -96.65 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.067 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 67' ' ' LEU . 0.4 OUTLIER 47.21 28.0 0.92 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.696 0.284 . . . . 0.0 111.155 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.8 mt -154.7 -45.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.161 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.824 HD13 ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.43 46.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.093 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PHE . . . . . 0.48 ' CG ' ' O ' ' A' ' 72' ' ' PHE . 10.6 p90 -123.28 74.42 50.76 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.939 0.4 . . . . 0.0 110.866 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.54 16.62 1.88 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.818 2.345 . . . . 0.0 112.867 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.626 HH11 HD21 ' A' ' 77' ' ' LEU . 0.3 OUTLIER -86.64 -58.32 2.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.839 0.352 . . . . 0.0 111.028 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 59.0 27.79 16.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -153.67 -53.09 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.793 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.626 HD21 HH11 ' A' ' 74' ' ' ARG . 4.6 pp -120.39 -173.45 2.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.808 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.755 ' CG ' HD23 ' A' ' 81' ' ' LEU . 3.0 m-20 -137.49 93.96 2.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.763 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.5 -38.88 88.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.881 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 1.063 HG22 HD11 ' B' ' 81' ' ' LEU . 42.5 mm -73.51 -43.26 55.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 1.077 HD11 HG22 ' B' ' 80' ' ' ILE . 1.7 mm? -74.18 -22.29 59.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.252 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.912 ' HA ' HD22 ' A' ' 86' ' ' LEU . 2.6 mttt -90.35 -27.71 19.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.872 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.84 -23.91 25.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.062 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.589 ' HB2' HD12 ' B' ' 81' ' ' LEU . 12.8 m-20 -103.92 104.15 14.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.04 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.477 ' HB3' HD21 ' B' ' 86' ' ' LEU . 58.3 m 60.85 113.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.972 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.912 HD22 ' HA ' ' A' ' 82' ' ' LYS . 6.4 tp -178.45 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.027 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.69 -25.04 17.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.046 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.757 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.0 OUTLIER -70.24 -10.16 58.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.301 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.549 HG21 ' HB ' ' B' ' 89' ' ' ILE . 17.1 mm -90.73 -56.79 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.593 ' O ' ' HB ' ' A' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.22 64.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.22 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.696 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -86.96 -56.11 3.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.252 179.397 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.757 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.1 mm? -51.74 -26.27 9.14 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.891 HD13 ' HB3' ' B' ' 93' ' ' LEU . 0.3 OUTLIER -90.46 -38.51 13.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.696 HG22 ' HA ' ' A' ' 91' ' ' ALA . 2.1 t -67.33 -11.22 57.07 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.1 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.25 -28.6 1.62 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.486 -0.864 . . . . 0.0 113.052 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.448 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -102.93 2.4 35.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.543 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 97' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 29.3 p90 -41.05 137.64 1.24 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.556 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.2 p . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.096 179.939 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.944 0.402 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -134.39 147.11 50.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.602 HD23 HG22 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -136.28 -52.83 0.73 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.671 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 97.3 m 21.28 -86.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 179.529 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.29 -68.24 0.3 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.889 0.376 . . . . 0.0 111.312 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.622 ' HA ' ' HB2' ' B' ' 60' ' ' ARG . 23.1 t -53.86 -28.01 16.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.687 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.7 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -66.42 -46.84 75.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.135 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.408 ' N ' ' HG2' ' B' ' 58' ' ' GLU . 0.3 OUTLIER -67.92 -17.42 64.45 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.394 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.622 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -73.75 0.17 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.737 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.832 ' CD1' HD22 ' B' ' 64' ' ' LEU . 4.1 mm? -62.17 -32.36 72.97 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.49 -0.884 . . . . 0.0 109.851 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.67 ' HB2' HD12 ' A' ' 61' ' ' LEU . 3.5 tt0 -61.39 -36.23 79.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.249 177.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -81.08 -16.12 54.05 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.047 0.451 . . . . 0.0 110.014 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 1.053 HD23 ' HG2' ' B' ' 65' ' ' GLU . 0.0 OUTLIER -79.17 -27.12 42.64 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.336 179.941 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 1.053 ' HG2' HD23 ' B' ' 64' ' ' LEU . 7.6 mm-40 -102.84 -21.66 13.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.109 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.63 -36.16 83.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.944 0.402 . . . . 0.0 110.065 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -83.04 -0.45 49.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.799 179.307 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' B' ' 67' ' ' LEU . 72.9 m-85 67.41 -96.42 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.107 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.589 ' O ' HD23 ' B' ' 69' ' ' LEU . 1.6 tt 47.06 27.98 0.84 Allowed 'General case' 0 CA--C 1.528 0.103 0 CA-C-O 120.71 0.291 . . . . 0.0 111.272 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 98.1 mt -154.81 -45.8 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.152 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.846 HD13 ' O ' ' B' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.083 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 72' ' ' PHE . . . . . 0.473 ' O ' ' CG ' ' B' ' 72' ' ' PHE . 10.6 p90 -123.25 74.46 50.56 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-O 120.963 0.411 . . . . 0.0 110.851 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -87.53 16.54 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.905 2.403 . . . . 0.0 112.898 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.68 -58.15 2.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.841 0.353 . . . . 0.0 110.941 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.07 29.91 19.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 -158.4 -50.61 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.776 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -120.15 -177.82 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.822 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 78' ' ' ASP . . . . . 0.741 ' CG ' HD23 ' B' ' 81' ' ' LEU . 3.0 m-20 -135.61 93.28 2.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.631 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.37 -38.86 88.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.928 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 1.077 HG22 HD11 ' A' ' 81' ' ' LEU . 42.5 mm -73.56 -43.2 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 1.063 HD11 HG22 ' A' ' 80' ' ' ILE . 1.7 mm? -74.17 -22.29 59.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.264 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -90.37 -27.68 19.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.867 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.98 25.08 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.998 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 84' ' ' ASP . . . . . 0.577 ' HB2' HD12 ' A' ' 81' ' ' LEU . 12.7 m-20 -103.86 104.26 14.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.959 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 85' ' ' SER . . . . . 0.556 ' HB3' HD11 ' A' ' 86' ' ' LEU . 58.4 m 60.71 112.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.866 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.477 HD21 ' HB3' ' A' ' 85' ' ' SER . 0.1 OUTLIER -177.45 -39.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.952 -179.945 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.23 -24.93 17.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.134 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.758 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.0 OUTLIER -70.19 -10.15 57.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.391 179.875 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.549 ' HB ' HG21 ' A' ' 89' ' ' ILE . 17.1 mm -90.8 -56.73 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.59 ' O ' ' HB ' ' B' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.19 64.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.263 177.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 91' ' ' ALA . . . . . 0.722 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.05 -56.09 3.53 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.201 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.758 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.1 mm? -51.72 -26.15 8.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.789 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.891 ' HB3' HD13 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -90.6 -38.58 13.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.676 179.408 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.722 HG22 ' HA ' ' B' ' 91' ' ' ALA . 2.1 t -67.2 -11.34 57.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.075 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.31 -28.44 1.64 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.552 -0.833 . . . . 0.0 113.053 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.446 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.4 OUTLIER -103.0 2.37 34.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.546 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 97' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 29.2 p90 -41.14 137.77 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.561 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.923 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.886 0.374 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' B' ' 53' ' ' HIS . 2.5 m-70 -92.52 127.4 38.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.165 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.702 HD12 HG13 ' B' ' 57' ' ' VAL . 6.3 tp -174.11 -90.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.003 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.57 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.6 m 3.02 -100.29 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.557 ' N ' HG22 ' A' ' 55' ' ' THR . 4.8 tp10 -35.97 -69.92 0.1 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.717 HG13 HD12 ' B' ' 54' ' ' LEU . 5.1 t -46.66 -29.93 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.553 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.63 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.4 pt-20 -66.88 -48.25 69.33 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 2.1 m -65.86 -14.63 61.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.201 177.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.431 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -77.03 -75.95 0.19 Allowed 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.835 -179.725 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 1.05 HD13 HD21 ' A' ' 64' ' ' LEU . 3.9 mm? -60.36 -25.3 65.75 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.803 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.556 ' HB2' HD12 ' B' ' 61' ' ' LEU . 11.4 tt0 -73.13 -37.08 66.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.0 mmt180 -58.82 -39.99 82.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.488 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 1.05 HD21 HD13 ' A' ' 61' ' ' LEU . 1.2 pp -78.46 -23.28 46.6 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.238 178.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.51 ' HB3' ' HA ' ' A' ' 62' ' ' GLU . 1.2 tp10 -65.68 -34.56 78.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.475 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -28.18 62.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.422 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.454 ' C ' ' CG ' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -92.68 -0.36 57.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.256 179.849 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.454 ' CG ' ' C ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER 47.13 -88.81 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.592 179.917 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 67' ' ' LEU . 3.6 tp 64.26 24.69 13.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.684 0.278 . . . . 0.0 110.894 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.5 mt -148.79 -48.55 0.15 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.551 ' H ' HD12 ' A' ' 71' ' ' ILE . 3.8 mp -82.82 -34.22 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.185 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.83 92.52 4.4 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.98 -170.37 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.471 2.114 . . . . 0.0 112.34 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -145.82 85.07 1.68 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.251 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.13 164.49 14.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.585 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.56 49.61 1.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.732 HD13 ' H ' ' A' ' 78' ' ' ASP . 0.2 OUTLIER -179.73 148.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.009 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.732 ' H ' HD13 ' A' ' 77' ' ' LEU . 1.2 p30 -86.97 79.8 8.63 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -50.65 -28.01 8.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.25 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.815 HG22 HD21 ' B' ' 81' ' ' LEU . 21.0 mt -76.7 -60.3 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.953 0.406 . . . . 0.0 110.732 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 1.07 HD22 HD22 ' B' ' 81' ' ' LEU . 2.3 mm? -54.68 -19.56 6.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.764 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.55 -25.11 13.33 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.1 mmm -98.94 -2.01 38.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.51 87.98 2.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.389 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.06 -156.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.733 HD12 ' HB3' ' B' ' 86' ' ' LEU . 4.3 mm? 63.26 29.63 15.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.835 0.35 . . . . 0.0 110.936 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.15 -42.33 1.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.608 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 17.4 t70 -70.71 -9.54 57.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.051 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.676 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.6 mp -88.66 -56.09 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.138 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.594 ' HG3' HG21 ' B' ' 89' ' ' ILE . 0.1 OUTLIER -63.41 -19.97 65.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.259 177.869 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.9 -63.74 1.27 Allowed 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.65 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.547 HD23 ' HB2' ' A' ' 96' ' ' LEU . 1.2 tt -51.54 -24.41 5.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.947 0.403 . . . . 0.0 110.431 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.499 ' HB3' HD12 ' B' ' 93' ' ' LEU . 3.8 mm? -90.12 -40.99 11.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.485 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.79 -13.63 59.81 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.167 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.28 -50.23 0.31 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.228 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.612 HD22 ' N ' ' A' ' 96' ' ' LEU . 2.6 mm? -98.12 -2.48 39.91 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.24 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.92 32.96 0.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.834 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.519 HG23 ' CB ' ' A' ' 96' ' ' LEU . 18.3 t . . . . . 0 C--N 1.33 -0.279 0 CA-C-O 120.931 0.396 . . . . 0.0 111.266 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.118 0 CA-C-O 120.851 0.358 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 53' ' ' HIS . 2.5 m-70 -92.74 127.43 38.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.075 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 54' ' ' LEU . . . . . 0.717 HD12 HG13 ' A' ' 57' ' ' VAL . 6.3 tp -174.08 -90.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.031 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.578 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 98.8 m 3.17 -100.37 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.559 ' N ' HG22 ' B' ' 55' ' ' THR . 4.8 tp10 -35.7 -70.15 0.09 Allowed 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 57' ' ' VAL . . . . . 0.702 HG13 HD12 ' A' ' 54' ' ' LEU . 5.3 t -46.68 -30.06 1.26 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.571 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.404 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 58' ' ' GLU . . . . . 0.636 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.4 pt-20 -66.71 -48.34 69.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 59' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 2.1 m -65.73 -14.62 61.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.288 177.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.425 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -77.02 -75.97 0.19 Allowed 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.798 -179.603 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 1.039 HD13 HD21 ' B' ' 64' ' ' LEU . 3.9 mm? -60.39 -25.31 65.81 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 119.74 -0.784 . . . . 0.0 109.793 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.575 ' HB2' HD12 ' A' ' 61' ' ' LEU . 11.3 tt0 -73.05 -37.18 66.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 63' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' B' ' 59' ' ' SER . 1.9 mmt180 -58.89 -39.9 82.8 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.542 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 1.039 HD21 HD13 ' B' ' 61' ' ' LEU . 1.2 pp -78.44 -23.33 46.66 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.272 178.677 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' GLU . . . . . 0.493 ' HB3' ' HA ' ' B' ' 62' ' ' GLU . 1.1 tp10 -65.64 -34.58 78.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.479 178.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.57 -28.18 62.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.402 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.444 ' C ' ' CG ' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -92.65 -0.23 57.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.266 179.803 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 68' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 46.96 -88.79 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.504 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.442 ' N ' ' O ' ' B' ' 67' ' ' LEU . 0.2 OUTLIER 64.19 24.81 13.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.694 0.283 . . . . 0.0 110.943 -179.849 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 mt -148.86 -48.65 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.91 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 71' ' ' ILE . . . . . 0.547 ' H ' HD12 ' B' ' 71' ' ' ILE . 3.8 mp -82.86 -34.0 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.26 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.95 92.47 4.46 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -68.9 -170.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.46 2.107 . . . . 0.0 112.411 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -146.76 81.04 1.55 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.543 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' B' ' 77' ' ' LEU . 3.6 mt-10 -119.96 12.79 12.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.638 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 66.12 -73.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.752 0.311 . . . . 0.0 110.889 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' B' ' 75' ' ' GLU . 0.5 OUTLIER -49.48 149.4 2.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.902 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 78' ' ' ASP . . . . . 0.508 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 1.4 p30 -93.42 79.52 4.39 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.096 0.474 . . . . 0.0 111.464 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -51.33 -27.79 10.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.062 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.799 HG22 ' CD2' ' A' ' 81' ' ' LEU . 20.9 mt -76.69 -60.24 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.95 0.405 . . . . 0.0 110.755 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 1.07 HD22 HD22 ' A' ' 81' ' ' LEU . 2.3 mm? -54.75 -19.59 6.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.701 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.41 -25.22 13.35 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 8.2 mmm -98.87 -2.04 38.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -178.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.42 88.02 2.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.03 -156.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.053 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.832 HD22 ' CD1' ' A' ' 81' ' ' LEU . 5.9 mp 63.28 29.54 15.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.904 0.383 . . . . 0.0 110.972 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.25 -42.48 1.51 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.732 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 17.4 t70 -70.65 -9.46 57.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.052 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.668 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.6 mp -88.67 -55.98 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 90' ' ' GLU . . . . . 0.59 ' HG3' HG21 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -63.35 -20.04 65.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.338 177.752 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.93 -63.72 1.27 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.614 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 92' ' ' LEU . . . . . 0.541 HD23 ' HB2' ' B' ' 96' ' ' LEU . 1.2 tt -51.52 -24.38 5.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.918 0.389 . . . . 0.0 110.433 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 93' ' ' LEU . . . . . 0.499 HD12 ' HB3' ' A' ' 93' ' ' LEU . 3.9 mm? -90.21 -40.96 11.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.403 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.84 -13.53 59.71 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.223 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.32 -50.2 0.31 Allowed Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.457 -0.878 . . . . 0.0 113.182 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.602 HD22 ' N ' ' B' ' 96' ' ' LEU . 2.6 mm? -98.18 -2.62 39.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.121 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.95 33.1 0.13 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.788 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 98' ' ' VAL . . . . . 0.523 HG23 ' CB ' ' B' ' 96' ' ' LEU . 18.6 t . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.227 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.3 p . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.72 0.295 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -170.33 -41.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.231 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -149.6 131.68 15.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 0.0 111.313 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.75 -31.29 6.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.817 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.64 HD23 HG13 ' B' ' 57' ' ' VAL . 9.0 mt 64.47 -80.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.239 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.502 ' C ' ' O ' ' A' ' 54' ' ' LEU . 97.2 m 6.54 -90.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.46 -70.05 0.12 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.639 HG13 HD23 ' B' ' 54' ' ' LEU . 4.6 t -50.18 -25.08 2.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.577 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.742 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.39 73.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.62 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.574 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 20.0 m -69.49 -15.72 63.31 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -73.38 -74.03 0.19 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.475 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.4 mm? -62.06 -28.29 69.49 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 119.362 -0.935 . . . . 0.0 109.992 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.536 ' HB2' HD12 ' B' ' 61' ' ' LEU . 2.6 tt0 -65.08 -39.04 92.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.2 ttm105 -66.73 -28.18 68.21 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.849 HD11 ' CD2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -72.77 -27.42 61.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.748 178.533 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.783 ' O ' HD11 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -78.01 -32.96 51.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.015 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.75 -22.93 45.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.6 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.826 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.9 tm? -77.56 -29.52 52.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.884 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.856 ' CD1' HD12 ' A' ' 71' ' ' ILE . 0.1 OUTLIER 72.34 -165.57 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.778 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.466 ' CB ' ' O ' ' A' ' 68' ' ' PHE . 8.0 tp 86.88 -33.05 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.85 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.849 ' CD2' HD11 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -113.68 -16.39 12.33 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.474 0.178 . . . . 0.0 111.225 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.856 HD12 ' CD1' ' A' ' 68' ' ' PHE . 60.8 mt -51.64 -37.18 19.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.714 0.293 . . . . 0.0 111.271 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.438 ' CG ' ' HD2' ' A' ' 73' ' ' PRO . 1.4 t80 -109.03 142.24 25.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.815 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.438 ' HD2' ' CG ' ' A' ' 72' ' ' PHE . 51.2 Cg_endo -69.15 -28.8 27.74 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.458 2.106 . . . . 0.0 112.291 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -112.13 -179.48 3.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.739 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -98.06 -49.29 4.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.056 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.07 146.47 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.023 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.688 HD12 HG13 ' A' ' 80' ' ' ILE . 0.8 OUTLIER -103.13 -80.05 0.52 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.738 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 71.85 -57.58 0.61 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.298 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.39 6.16 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.684 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.688 HG13 HD12 ' A' ' 77' ' ' LEU . 58.0 mt -61.16 -29.97 46.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 111.144 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.787 ' O ' HD12 ' A' ' 86' ' ' LEU . 1.4 mt -73.2 -26.7 61.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.049 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.8 -19.63 22.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.5 mtm -93.01 -22.88 18.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.039 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -86.8 -60.72 1.91 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.65 120.41 0.91 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.882 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.787 HD12 ' O ' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -169.76 -41.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.018 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -74.08 -38.74 63.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.029 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.782 ' O ' HD23 ' A' ' 92' ' ' LEU . 5.1 m-20 -70.36 -11.41 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.698 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.1 mp -91.55 -54.95 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.24 -19.63 64.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.33 4.26 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.158 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.782 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.3 mm? -53.08 -26.18 15.33 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.081 0.467 . . . . 0.0 109.841 178.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.441 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 0.5 OUTLIER -92.55 -38.05 12.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.165 179.206 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.5 m -63.3 -15.05 56.08 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.012 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.7 -28.85 1.11 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.41 -0.9 . . . . 0.0 113.395 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.31 5.41 34.54 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 21.9 p90 -36.69 139.56 0.18 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.688 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 28.0 t -71.0 117.39 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.082 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -74.92 -31.05 61.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.971 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.77 163.1 15.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.427 ' O ' HG12 ' A' ' 102' ' ' VAL . 1.2 t-20 -115.63 -41.69 3.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.98 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' ' 102' ' ' VAL . 14.1 p 43.9 44.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.653 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.9 p30 42.92 92.18 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.431 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.5 mttm -108.9 -15.77 14.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.25 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -96.58 33.4 1.83 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.926 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.16 179.956 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.821 0.343 . . . . 0.0 111.246 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -123.23 -78.53 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.891 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.58 131.73 13.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.319 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.64 -31.29 6.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.858 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.639 HD23 HG13 ' A' ' 57' ' ' VAL . 9.0 mt 64.32 -80.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.215 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.499 ' C ' ' O ' ' B' ' 54' ' ' LEU . 97.6 m 6.39 -90.47 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -70.17 0.11 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.948 0.404 . . . . 0.0 112.083 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.64 HG13 HD23 ' A' ' 54' ' ' LEU . 4.6 t -50.15 -25.0 2.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.562 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.732 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.43 73.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.612 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.578 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 19.9 m -69.45 -15.68 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.472 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.3 OUTLIER -73.46 -74.0 0.19 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.505 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.742 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.4 mm? -62.02 -28.34 69.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.841 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.53 ' HB2' HD12 ' A' ' 61' ' ' LEU . 2.6 tt0 -65.15 -38.97 92.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.1 ttm105 -66.82 -28.03 68.03 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.847 HD11 ' CD2' ' B' ' 70' ' ' LEU . 0.1 OUTLIER -72.96 -27.49 61.85 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.567 178.644 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.785 ' O ' HD11 ' B' ' 71' ' ' ILE . 0.1 OUTLIER -77.96 -33.02 51.73 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.027 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.67 -23.01 45.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.596 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.838 HD13 ' O ' ' B' ' 67' ' ' LEU . 2.9 tm? -77.47 -29.48 52.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.987 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.858 ' CD1' HD12 ' B' ' 71' ' ' ILE . 0.1 OUTLIER 72.24 -165.46 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.826 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' B' ' 68' ' ' PHE . 0.3 OUTLIER 86.58 -33.01 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.891 179.67 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.847 ' CD2' HD11 ' B' ' 64' ' ' LEU . 0.1 OUTLIER -113.49 -16.37 12.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.525 0.203 . . . . 0.0 111.254 -179.779 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.858 HD12 ' CD1' ' B' ' 68' ' ' PHE . 60.9 mt -51.66 -37.1 19.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.767 0.318 . . . . 0.0 111.354 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 72' ' ' PHE . . . . . 0.441 ' CG ' ' HD2' ' B' ' 73' ' ' PRO . 1.4 t80 -109.04 142.1 24.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.774 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' B' ' 72' ' ' PHE . 51.3 Cg_endo -69.14 -28.75 27.84 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.447 2.098 . . . . 0.0 112.361 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -111.84 179.77 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.875 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -93.45 -60.33 1.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.988 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.49 155.72 26.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.856 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.765 HD22 HD12 ' B' ' 80' ' ' ILE . 1.9 mt -109.21 -79.04 0.59 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.785 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 72.85 -57.87 0.62 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.399 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.44 6.12 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.768 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.765 HD12 HD22 ' B' ' 77' ' ' LEU . 58.1 mt -61.1 -30.08 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.057 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 81' ' ' LEU . 1.4 mt -73.11 -26.82 61.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.065 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.68 -19.65 22.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.212 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 9.6 mtm -93.05 -22.84 18.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 0.0 111.053 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ASP . . . . . 0.405 ' HB3' ' CD1' ' A' ' 81' ' ' LEU . 1.7 m-20 -86.79 -60.76 1.9 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.901 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.68 120.53 0.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.98 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.545 ' CA ' HD13 ' B' ' 89' ' ' ILE . 0.5 OUTLIER -169.78 -42.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -73.71 -38.72 64.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.982 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.803 ' O ' HD23 ' B' ' 92' ' ' LEU . 5.1 m-20 -70.38 -11.47 60.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.34 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.711 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.1 mp -91.52 -55.09 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.21 -19.55 64.62 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.136 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.28 4.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.255 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.803 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.3 mm? -53.12 -26.1 15.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.047 0.451 . . . . 0.0 109.833 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -92.56 -38.12 12.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.087 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -63.21 -15.23 56.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.98 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.55 -28.96 1.12 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.412 -0.899 . . . . 0.0 113.37 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.534 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.5 OUTLIER -104.23 5.33 34.7 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.327 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.445 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 21.5 p90 -36.73 139.51 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.68 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 27.2 t -70.94 117.51 14.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.103 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -74.99 -31.05 61.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.96 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.79 163.1 15.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.861 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 101' ' ' ASN . . . . . 0.435 ' O ' HG12 ' B' ' 102' ' ' VAL . 1.2 t-20 -115.56 -41.71 3.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.023 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.594 HG22 ' O ' ' B' ' 102' ' ' VAL . 14.4 p 43.75 44.8 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.658 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 6.9 p30 42.97 92.09 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.521 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -108.84 -15.89 14.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.174 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -96.25 33.17 1.8 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.79 0.329 . . . . 0.0 111.015 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.174 -179.974 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.805 0.336 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.38 139.35 35.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.439 ' HB1' ' NE2' ' B' ' 53' ' ' HIS . . . -176.84 -162.61 0.08 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.049 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.444 ' NE2' ' HB1' ' B' ' 52' ' ' ALA . 39.8 m80 65.23 153.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.438 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.624 HD12 ' N ' ' A' ' 54' ' ' LEU . 4.6 mp 64.26 -137.52 0.29 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.705 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.435 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.7 m 27.94 -84.94 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 54' ' ' LEU . 4.1 mm-40 -66.41 -64.43 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.138 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.623 ' HB ' HG11 ' B' ' 57' ' ' VAL . 20.6 t -56.84 -44.11 81.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.193 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.699 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 4.7 pt-20 -55.4 -48.68 73.99 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-O 121.451 0.643 . . . . 0.0 109.514 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.436 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 1.2 m -64.38 -19.06 65.25 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.654 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.04 -73.85 0.19 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.228 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.694 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.5 mm? -62.97 -25.36 68.33 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.09 -179.099 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.561 ' HB2' HD12 ' B' ' 61' ' ' LEU . 2.5 tt0 -69.33 -38.3 78.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.1 OUTLIER -65.38 -30.36 71.17 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 177.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.451 178.32 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.403 ' HA ' ' HG3' ' B' ' 65' ' ' GLU . 0.0 OUTLIER -73.53 -32.15 64.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.163 178.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.96 -23.12 44.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.843 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.99 -22.84 33.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 63.76 175.65 0.17 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.967 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tp -129.71 -66.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.973 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.5 mt -124.6 47.25 2.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.18 -58.05 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.086 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -113.73 101.72 54.08 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.82 -51.2 1.36 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.391 2.06 . . . . 0.0 112.348 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.57 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.804 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -175.99 118.22 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.002 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -159.08 -63.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 74.59 5.66 4.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -130.94 -34.04 1.51 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.659 0.266 . . . . 0.0 111.354 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -28.02 61.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.333 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.67 -65.03 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.005 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.457 ' H ' HD23 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -62.67 -18.75 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.07 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -80.72 -31.83 35.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 mtm -89.1 -18.2 27.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.98 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -94.25 -40.29 10.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.91 0.386 . . . . 0.0 110.847 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.03 139.07 30.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.45 18.16 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.112 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.78 23.25 11.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.128 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.491 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.9 OUTLIER -73.83 -11.29 60.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.896 0.379 . . . . 0.0 110.936 179.442 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.711 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.4 mp -93.31 -50.93 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.83 -21.58 66.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.459 -0.791 . . . . 0.0 108.931 177.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.02 -48.97 7.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.195 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.491 HD12 ' O ' ' A' ' 88' ' ' ASP . 12.7 mt -56.86 -25.27 56.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.202 0.525 . . . . 0.0 109.778 178.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.12 -36.68 11.96 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.225 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.0 m -65.82 -15.41 62.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.933 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.37 -36.36 0.65 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.218 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.452 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -97.94 -2.28 40.93 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.4 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 18.2 p90 38.78 75.84 0.07 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.806 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 42.1 t -72.0 141.12 17.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.935 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -154.23 108.08 2.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.894 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -176.98 166.73 2.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.922 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.41 151.54 19.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.89 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.431 HG23 ' N ' ' A' ' 103' ' ' ASN . 14.0 m -148.42 -45.57 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.245 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.431 ' N ' HG23 ' A' ' 102' ' ' VAL . 34.8 m-80 64.85 -175.75 0.17 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.875 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -126.16 152.74 45.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.918 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.28 113.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.936 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.312 -0.852 . . . . 0.0 111.158 179.932 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 13.4 m . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.814 0.34 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 14.7 mtt85 -157.61 36.96 0.27 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.801 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' ALA . . . . . 0.444 ' HB1' ' NE2' ' A' ' 53' ' ' HIS . . . -176.73 -162.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.181 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.439 ' NE2' ' HB1' ' A' ' 52' ' ' ALA . 40.0 m80 65.38 153.66 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.027 0.442 . . . . 0.0 111.238 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.622 ' N ' HD12 ' B' ' 54' ' ' LEU . 4.5 mp 64.13 -137.5 0.3 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.768 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.4 m 27.88 -84.83 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' B' ' 54' ' ' LEU . 4.1 mm-40 -66.45 -64.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.794 0.331 . . . . 0.0 111.192 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.623 HG11 ' HB ' ' A' ' 57' ' ' VAL . 20.6 t -56.86 -44.12 81.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.119 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.694 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 4.7 pt-20 -55.54 -48.49 74.64 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.336 0.589 . . . . 0.0 109.477 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 1.2 m -64.5 -19.06 65.36 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.099 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.24 -73.66 0.2 Allowed 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.203 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.5 mm? -63.14 -25.16 68.22 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.126 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.531 ' HB2' HD12 ' A' ' 61' ' ' LEU . 2.4 tt0 -69.52 -38.2 77.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 176.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -30.42 71.22 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.395 178.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.403 ' HG3' ' HA ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -73.5 -32.21 64.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.129 179.037 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -23.2 44.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.834 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -22.86 33.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.145 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 63.81 175.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.911 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 mp -129.59 -67.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 42.7 mt -124.01 47.36 2.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.104 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.27 -58.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' PHE . . . . . 0.405 ' HA ' ' HD2' ' B' ' 73' ' ' PRO . 7.5 m-85 -113.66 101.79 54.12 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' B' ' 72' ' ' PHE . 36.7 Cg_endo -65.85 -51.19 1.35 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.325 2.017 . . . . 0.0 112.462 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.66 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.114 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -152.1 -174.64 4.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.924 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 68.93 114.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.069 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.0 mp -101.64 47.62 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.645 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -127.25 -34.03 2.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.18 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -28.06 62.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.195 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.61 -65.05 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.988 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.467 ' H ' HD23 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -62.65 -18.8 63.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.04 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -80.7 -31.88 36.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 0.0 110.742 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 1.2 mtm -88.98 -18.34 27.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.93 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -94.28 -40.18 10.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.774 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.12 139.03 30.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.882 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.6 tp -94.51 18.16 11.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.91 23.2 11.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.128 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.473 ' O ' HD12 ' B' ' 92' ' ' LEU . 0.9 OUTLIER -73.92 -11.25 60.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 0.0 110.893 179.52 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.701 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.4 mp -93.11 -51.06 11.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.02 -21.34 66.83 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.809 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.07 -49.03 7.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.211 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.473 HD12 ' O ' ' B' ' 88' ' ' ASP . 12.7 mt -56.85 -25.27 56.03 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.104 0.478 . . . . 0.0 109.726 178.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.05 -36.76 11.97 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.154 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.9 m -65.87 -15.45 62.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.814 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.33 -36.46 0.65 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.27 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.445 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.4 OUTLIER -97.96 -2.33 40.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.997 0.399 . . . . 0.0 112.049 -179.363 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.403 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 18.0 p90 38.8 75.79 0.07 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.749 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 41.9 t -71.95 141.02 17.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.043 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -154.07 108.07 3.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.964 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -177.12 166.65 2.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.822 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.32 151.66 19.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.852 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.435 HG23 ' N ' ' B' ' 103' ' ' ASN . 14.0 m -148.49 -45.71 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.182 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' ASN . . . . . 0.435 ' N ' HG23 ' B' ' 102' ' ' VAL . 35.4 m-80 64.9 -175.7 0.17 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.815 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.23 152.75 45.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.958 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.35 113.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.917 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.171 179.969 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.9 t . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.717 0.294 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.685 ' HB3' HD13 ' A' ' 54' ' ' LEU . 1.3 mtt85 -94.42 -47.64 6.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.027 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 51' ' ' ARG . . . 67.42 131.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.3 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 51.63 -97.74 0.06 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.929 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.685 HD13 ' HB3' ' A' ' 51' ' ' ARG . 0.4 OUTLIER 66.14 -73.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.601 0.238 . . . . 0.0 111.335 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.449 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 55.7 m 9.34 -76.54 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.6 pt-20 -63.27 -60.56 3.24 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.67 ' HB ' HG11 ' B' ' 57' ' ' VAL . 17.2 t -59.12 -48.58 86.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.651 -179.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.724 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.02 -46.41 68.4 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 121.292 0.568 . . . . 0.0 109.555 179.035 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.7 -21.42 66.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.544 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.45 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.3 -71.59 0.25 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.381 -179.387 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -62.1 -30.68 71.18 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.812 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.453 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 45.7 tt0 -63.29 -37.56 87.73 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.89 -29.93 69.15 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.8 -27.78 64.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 121.484 0.659 . . . . 0.0 109.516 178.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -78.56 -31.77 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.502 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.67 -33.43 66.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.764 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 3.9 mp -63.08 -26.05 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.471 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 3.2 m-85 68.71 -61.0 0.43 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.442 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 70.71 -65.38 0.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.768 0.318 . . . . 0.0 110.667 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 30.9 mt -137.41 53.9 1.85 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.606 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.895 HG23 HG23 ' B' ' 71' ' ' ILE . 36.1 mm -127.14 -45.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.187 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.431 ' O ' ' CD2' ' A' ' 72' ' ' PHE . 37.6 p90 -48.0 105.5 0.5 Allowed Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.213 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -79.15 132.65 10.49 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.136 . . . . 0.0 112.289 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.0 -46.86 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.61 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -165.67 65.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.043 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.56 -81.16 0.36 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.7 mt -96.93 112.09 24.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.647 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.491 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 4.0 t0 -178.94 89.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.98 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.49 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 13.6 ptt? -53.09 -45.26 68.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.684 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.896 HG13 HD11 ' B' ' 81' ' ' LEU . 45.1 mm -65.07 -49.57 78.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.775 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.925 HD11 HG13 ' B' ' 80' ' ' ILE . 1.2 mm? -64.84 -21.29 66.76 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 9.0 pttp -93.54 -24.71 17.87 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.5 ' HE3' HD13 ' A' ' 80' ' ' ILE . 18.5 ptp -93.91 -15.26 25.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.82 -65.37 0.31 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.75 0.309 . . . . 0.0 110.935 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.621 ' O ' HD12 ' A' ' 86' ' ' LEU . 42.9 m 65.04 65.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.651 HD23 HG13 ' B' ' 89' ' ' ILE . 1.5 mp -150.15 32.67 0.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.703 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -112.99 -35.91 5.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.994 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.635 ' O ' HD13 ' A' ' 92' ' ' LEU . 2.3 m-20 -71.75 -13.47 61.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 111.031 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.786 HG13 HD23 ' B' ' 86' ' ' LEU . 26.2 mm -86.16 -57.37 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.551 ' O ' ' HB ' ' A' ' 94' ' ' THR . 30.2 tt0 -64.13 -18.84 64.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.303 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.703 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -83.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.525 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.635 HD13 ' O ' ' A' ' 88' ' ' ASP . 6.5 mp -49.31 -29.22 5.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.024 0.44 . . . . 0.0 110.448 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.476 ' HG ' ' HA ' ' B' ' 90' ' ' GLU . 4.3 mm? -85.24 -38.97 18.31 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.5 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.703 HG22 ' HA ' ' A' ' 91' ' ' ALA . 8.7 t -73.16 -7.59 52.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.957 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -113.05 -32.53 2.19 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 96' ' ' LEU . 2.8 mm? -98.31 -7.42 29.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.975 0.388 . . . . 0.0 111.843 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 44.8 p90 31.92 42.03 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.887 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 99' ' ' GLN . 11.4 p -81.42 158.24 4.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.284 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.48 ' N ' HG22 ' A' ' 98' ' ' VAL . 1.0 OUTLIER -112.13 81.45 1.47 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.85 -179.999 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.88 175.73 2.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.895 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -111.32 140.48 45.86 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.956 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 m -148.6 166.66 4.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.141 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -111.98 167.17 10.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.939 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.4 -57.76 2.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.813 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -63.43 -49.08 75.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.913 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.18 179.912 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 81.8 p . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.795 0.331 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' B' ' 52' ' ' ALA . 1.8 mtp180 62.3 -165.44 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.759 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' B' ' 51' ' ' ARG . . . 68.09 131.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.854 0.359 . . . . 0.0 111.055 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.4 ' O ' ' N ' ' B' ' 55' ' ' THR . 5.5 t-80 51.79 -97.75 0.06 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.896 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.606 ' HG ' HG13 ' A' ' 57' ' ' VAL . 0.4 OUTLIER 66.18 -73.94 0.07 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.664 0.268 . . . . 0.0 111.317 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.458 ' O ' ' HG3' ' B' ' 58' ' ' GLU . 57.3 m 9.45 -76.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.6 pt-20 -63.31 -60.47 3.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.67 HG11 ' HB ' ' A' ' 57' ' ' VAL . 17.1 t -59.05 -48.63 86.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 122.157 -0.339 . . . . 0.0 111.665 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.741 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.08 -46.37 68.58 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.345 0.593 . . . . 0.0 109.583 179.11 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.66 -21.52 66.75 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.536 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.432 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.15 -71.83 0.24 Allowed 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.285 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -62.04 -30.77 71.2 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 119.467 -0.893 . . . . 0.0 109.798 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.455 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 45.6 tt0 -63.14 -37.53 87.6 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.79 -29.97 69.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.258 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -27.81 64.14 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.498 178.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -78.59 -31.75 47.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.553 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.65 -33.34 66.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.861 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.47 ' O ' ' HB2' ' B' ' 68' ' ' PHE . 3.9 mp -63.11 -26.2 68.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.378 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' B' ' 69' ' ' LEU . 3.2 m-85 68.77 -60.52 0.44 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.631 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' B' ' 68' ' ' PHE . 2.0 mt 69.51 -64.58 0.34 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.818 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' B' ' 70' ' ' LEU . 30.7 mt -137.57 53.86 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.973 0.416 . . . . 0.0 110.666 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.895 HG23 HG23 ' A' ' 71' ' ' ILE . 36.8 mm -127.21 -44.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.173 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 72' ' ' PHE . . . . . 0.43 ' CD2' ' O ' ' B' ' 72' ' ' PHE . 37.7 p90 -47.96 105.42 0.49 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.212 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -79.11 132.69 10.56 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.532 2.154 . . . . 0.0 112.24 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.2 -50.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.12 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.34 31.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.88 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -141.79 136.9 31.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.856 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 mt 65.47 83.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.047 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' ASP . . . . . 0.473 ' HB3' ' HB2' ' B' ' 81' ' ' LEU . 4.0 t0 -173.36 88.37 0.07 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.856 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.515 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 13.7 ptt? -53.02 -45.2 67.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.639 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.925 HG13 HD11 ' A' ' 81' ' ' LEU . 45.0 mm -65.22 -49.49 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.686 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.896 HD11 HG13 ' A' ' 80' ' ' ILE . 1.2 mm? -64.96 -21.22 66.8 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' LYS . . . . . 0.515 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 8.9 pttp -93.64 -24.66 17.81 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 83' ' ' MET . . . . . 0.518 ' HE3' HD13 ' B' ' 80' ' ' ILE . 18.4 ptp -93.87 -15.22 25.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.621 0.248 . . . . 0.0 111.651 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.74 -65.33 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.726 0.298 . . . . 0.0 110.975 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 43.0 m 65.13 64.89 0.6 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.786 HD23 HG13 ' A' ' 89' ' ' ILE . 1.2 mp -149.43 32.74 0.72 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.738 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -113.15 -36.05 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.199 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.634 ' O ' HD13 ' B' ' 92' ' ' LEU . 2.3 m-20 -71.72 -13.45 61.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 111.047 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.651 HG13 HD23 ' A' ' 86' ' ' LEU . 26.0 mm -86.15 -57.43 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 94' ' ' THR . 30.1 tt0 -63.9 -19.08 64.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.354 178.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 91' ' ' ALA . . . . . 0.709 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -83.84 -67.55 0.78 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.653 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.634 HD13 ' O ' ' B' ' 88' ' ' ASP . 6.5 mp -49.31 -29.37 5.93 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.961 0.41 . . . . 0.0 110.37 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.476 ' HG ' ' HA ' ' A' ' 90' ' ' GLU . 4.3 mm? -85.14 -38.93 18.47 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.56 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.709 HG22 ' HA ' ' B' ' 91' ' ' ALA . 8.8 t -73.15 -7.7 52.55 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.983 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -112.92 -32.49 2.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.857 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 2.8 mm? -98.39 -7.39 28.83 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 117.023 0.411 . . . . 0.0 111.753 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 44.5 p90 31.82 42.11 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.843 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.49 HG22 ' N ' ' B' ' 99' ' ' GLN . 11.4 p -81.39 158.26 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.396 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.49 ' N ' HG22 ' B' ' 98' ' ' VAL . 1.0 OUTLIER -112.16 81.54 1.48 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.85 175.7 2.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.9 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -111.3 140.38 45.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.949 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 m -148.54 166.71 4.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.218 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -112.02 166.99 10.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.837 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.29 -57.69 2.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.893 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -63.37 -49.09 75.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.935 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.093 179.964 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.824 0.345 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 30.1 mtt-85 -141.29 154.65 45.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.86 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -172.8 126.9 0.48 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.088 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.642 ' C ' HD12 ' A' ' 54' ' ' LEU . 18.6 p-80 -106.72 86.94 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.036 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.642 HD12 ' C ' ' A' ' 53' ' ' HIS . 11.1 mp -128.41 8.93 6.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.301 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.492 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.2 OUTLIER -52.8 -56.29 16.79 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.612 -179.796 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.66 -42.64 64.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.247 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.738 ' HB ' HG11 ' B' ' 57' ' ' VAL . 2.5 t -62.99 -38.71 82.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 CA-C-O 120.868 0.366 . . . . 0.0 111.114 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.679 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -61.22 -52.05 66.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.851 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 t -61.28 -20.22 62.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.291 177.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.437 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 11.4 tpp180 -69.66 -73.59 0.15 Allowed 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.346 -179.14 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.845 HD13 HD22 ' A' ' 64' ' ' LEU . 4.2 mm? -62.63 -30.16 71.15 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.024 -1.071 . . . . 0.0 110.025 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.63 ' HB2' HD12 ' B' ' 61' ' ' LEU . 65.4 tt0 -62.5 -36.67 83.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.314 177.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.86 -15.28 48.77 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.845 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -86.27 -21.48 27.34 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.239 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.549 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 2.4 mm-40 -112.47 -18.32 12.46 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.331 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.29 89.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.405 ' N ' ' O ' ' A' ' 65' ' ' GLU . 7.0 mt 62.78 17.1 9.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.38 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.417 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 1.4 t80 -103.51 98.4 8.3 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.728 0.299 . . . . 0.0 111.026 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tt -177.19 -72.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.024 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.27 -39.02 0.15 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.915 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.637 HG23 HG12 ' A' ' 80' ' ' ILE . 16.6 mm -48.72 -26.99 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.566 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.73 77.19 0.39 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.847 0.356 . . . . 0.0 111.0 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.26 -46.66 1.34 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.575 2.183 . . . . 0.0 112.3 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.56 74.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.003 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 67.84 -69.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.058 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -70.66 138.67 50.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 pp -100.55 131.4 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.912 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.89 -38.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.954 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.06 -23.18 31.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.096 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.637 HG12 HG23 ' A' ' 71' ' ' ILE . 2.9 mp -62.6 -50.76 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.335 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.37 -11.13 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.475 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -88.55 -22.92 23.32 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.67 0.271 . . . . 0.0 111.191 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.5 mtm -116.1 -43.54 2.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.353 . . . . 0.0 111.002 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.53 89.69 3.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.869 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 87.6 p -158.35 154.81 27.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.08 13.69 18.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.261 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.84 17.21 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.246 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.793 ' O ' HD23 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -73.35 -14.61 61.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.07 179.779 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.415 ' CG2' ' HB ' ' B' ' 89' ' ' ILE . 10.6 mm -92.99 -50.37 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.421 ' OE2' HD23 ' B' ' 93' ' ' LEU . 3.8 tt0 -63.4 -21.86 66.54 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.93 -52.0 5.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.1 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 88' ' ' ASP . 2.3 mm? -52.33 -27.34 14.99 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.182 0.515 . . . . 0.0 109.619 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.596 HD12 HD12 ' B' ' 93' ' ' LEU . 0.2 OUTLIER -91.01 -36.93 13.78 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.04 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.21 -13.62 50.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.872 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.71 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.214 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.54 HD13 ' O ' ' A' ' 96' ' ' LEU . 0.2 OUTLIER -101.22 3.63 41.11 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.559 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.662 ' O ' HG12 ' A' ' 98' ' ' VAL . 21.2 p90 -41.84 133.22 2.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.596 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.662 HG12 ' O ' ' A' ' 97' ' ' PHE . 3.0 p 51.67 168.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.992 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.534 ' H ' HG22 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -159.5 123.94 3.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.703 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.33 147.9 45.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.064 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 59.41 160.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.048 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.5 t 61.45 153.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.14 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -131.0 -178.05 4.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.55 144.45 35.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.87 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.02 163.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.948 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.073 179.967 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 7.2 m . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.801 0.334 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.67 -57.72 2.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.776 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -172.62 126.87 0.5 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.028 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.633 ' C ' HD12 ' B' ' 54' ' ' LEU . 18.3 p-80 -106.83 87.04 2.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.942 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.633 HD12 ' C ' ' B' ' 53' ' ' HIS . 11.0 mp -128.38 8.91 6.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.418 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.489 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -52.77 -56.33 16.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 111.523 -179.787 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.77 -42.59 65.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.227 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.738 HG11 ' HB ' ' A' ' 57' ' ' VAL . 2.4 t -62.82 -38.76 82.64 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-O 120.926 0.393 . . . . 0.0 111.172 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.659 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -61.26 -52.08 66.24 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 7.7 t -61.29 -20.26 62.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.381 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.445 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 11.5 tpp180 -69.69 -73.58 0.16 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.297 -179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.822 HD13 HD22 ' B' ' 64' ' ' LEU . 4.2 mm? -62.45 -30.45 71.25 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.081 -1.048 . . . . 0.0 110.018 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.634 ' HB2' HD12 ' A' ' 61' ' ' LEU . 65.3 tt0 -62.45 -36.49 82.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.372 177.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.94 -15.3 48.4 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.634 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.822 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -86.32 -21.5 27.24 Favored 'General case' 0 CA--C 1.523 -0.093 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.289 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 2.4 mm-40 -112.38 -18.43 12.47 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.384 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.23 89.19 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.952 0.406 . . . . 0.0 111.007 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.403 ' N ' ' O ' ' B' ' 65' ' ' GLU . 7.0 mt 62.92 16.87 9.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.359 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' B' ' 64' ' ' LEU . 1.4 t80 -103.32 98.34 8.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.758 0.314 . . . . 0.0 110.994 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tp -176.93 -73.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.998 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 -39.02 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.981 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.613 HG23 HG12 ' B' ' 80' ' ' ILE . 16.5 mm -48.57 -27.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.637 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.78 77.22 0.39 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.972 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.1 -46.59 1.43 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.525 2.15 . . . . 0.0 112.429 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.57 74.0 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 67.8 -67.83 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.145 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.28 138.17 49.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.979 0.418 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.17 129.98 46.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.828 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.55 -38.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.936 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.07 -23.2 32.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.172 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.613 HG12 HG23 ' B' ' 71' ' ' ILE . 2.9 mp -62.36 -50.95 77.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.376 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.4 -11.0 47.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.55 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -88.66 -22.77 23.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.739 0.304 . . . . 0.0 111.265 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.6 mtm -116.26 -43.52 2.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.91 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.57 89.74 3.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 86.5 p -158.4 154.8 27.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.833 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 mt -92.06 13.67 18.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.93 17.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.272 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.777 ' O ' HD23 ' B' ' 92' ' ' LEU . 0.3 OUTLIER -73.36 -14.54 61.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.102 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.415 ' HB ' ' CG2' ' A' ' 89' ' ' ILE . 10.6 mm -93.05 -50.34 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.425 ' OE2' HD23 ' A' ' 93' ' ' LEU . 3.8 tt0 -63.39 -21.82 66.52 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 177.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.04 -51.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.994 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.777 HD23 ' O ' ' B' ' 88' ' ' ASP . 2.3 mm? -52.35 -27.32 15.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.282 0.563 . . . . 0.0 109.597 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.596 HD12 HD12 ' A' ' 93' ' ' LEU . 0.2 OUTLIER -91.08 -36.84 13.78 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.078 178.981 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.18 -13.71 50.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.916 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.7 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.195 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.547 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -101.19 3.72 41.28 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.669 ' O ' HG12 ' B' ' 98' ' ' VAL . 21.4 p90 -41.82 133.16 2.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.698 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.669 HG12 ' O ' ' B' ' 97' ' ' PHE . 3.0 p 51.71 168.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.048 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.53 ' H ' HG22 ' B' ' 98' ' ' VAL . 0.0 OUTLIER -159.39 123.94 3.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.759 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.31 147.87 45.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.085 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 59.46 160.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.047 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 21.4 t 61.47 153.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.121 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -131.05 -178.13 4.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -140.53 144.38 35.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.911 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.98 163.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.9 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.164 -179.889 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.771 0.319 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 -170.33 2.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.797 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' CB ' ' A' ' 55' ' ' THR . . . -62.07 -22.78 66.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.255 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.587 ' O ' HG21 ' B' ' 57' ' ' VAL . 14.4 m-70 63.6 -80.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.977 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.506 HD23 HG13 ' B' ' 57' ' ' VAL . 0.8 OUTLIER -94.78 -68.12 0.82 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.827 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.665 ' CB ' ' HB1' ' A' ' 52' ' ' ALA . 97.9 m 22.23 -86.17 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.8 mt-10 -60.06 -68.34 0.3 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.87 0.367 . . . . 0.0 111.495 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.6 HG21 ' O ' ' B' ' 53' ' ' HIS . 41.4 t -56.77 -21.78 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.672 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.692 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.9 pt-20 -70.31 -45.95 65.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.429 ' N ' ' HG2' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -68.52 -17.15 64.1 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.241 -0.89 . . . . 0.0 108.961 177.136 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 0.4 OUTLIER -73.76 -75.23 0.16 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.529 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.3 mm? -60.62 -29.11 69.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.072 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.659 ' HB2' HD12 ' B' ' 61' ' ' LEU . 3.5 tt0 -66.35 -38.2 87.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.051 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 59' ' ' SER . 6.2 ttt85 -66.83 -27.69 67.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.4 HD11 HD21 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -75.42 -27.31 58.96 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.601 178.649 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 8.4 tm-20 -78.29 -30.06 48.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.403 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.42 -31.14 69.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.712 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.49 -10.77 45.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.226 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 63.41 143.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.787 0.327 . . . . 0.0 110.983 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.441 HD11 ' OE1' ' B' ' 65' ' ' GLU . 2.3 mt -93.84 -63.49 1.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.845 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 31.5 mt -147.0 33.53 0.91 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.4 HD12 ' CZ ' ' B' ' 68' ' ' PHE . 23.6 mm -89.74 -58.81 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.218 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.3 112.24 46.7 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.975 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.51 -160.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.52 2.147 . . . . 0.0 112.285 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -134.56 162.1 33.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.348 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 56.52 -157.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.669 0.271 . . . . 0.0 110.927 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -78.41 -38.07 42.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.523 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.5 mt -46.94 114.47 0.85 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.076 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.487 ' OD2' HD11 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -130.72 106.28 8.36 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.13 0.49 . . . . 0.0 112.001 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.471 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -68.88 -39.2 79.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.615 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.91 -46.84 95.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.879 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.558 ' CD2' HD23 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -78.95 -25.75 43.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.923 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.471 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -84.59 -18.39 35.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.329 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 32.3 mtm -107.92 -23.29 12.1 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.539 ' CB ' HD13 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -58.19 -75.0 0.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.8 0.334 . . . . 0.0 111.304 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -174.27 127.65 0.35 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.116 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.47 HD23 ' O ' ' A' ' 81' ' ' LEU . 1.2 pp -158.43 29.34 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.585 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -97.42 -15.34 20.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.266 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 65.1 m-20 -70.6 -12.09 61.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.913 0.387 . . . . 0.0 111.163 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.644 ' HB ' HG21 ' B' ' 89' ' ' ILE . 11.2 mm -86.92 -57.51 4.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 94' ' ' THR . 40.0 tt0 -63.28 -19.21 64.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.179 177.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.597 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -83.27 -68.64 0.69 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.258 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.439 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.3 tt -47.52 -28.27 2.16 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.118 0.485 . . . . 0.0 110.263 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 89' ' ' ILE . 0.3 OUTLIER -83.25 -40.47 19.55 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.644 179.125 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.597 HG22 ' HA ' ' A' ' 91' ' ' ALA . 4.0 t -69.22 -9.53 53.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.889 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.94 -33.57 3.0 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.197 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.7 OUTLIER -87.77 -8.04 56.52 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 120.974 0.416 . . . . 0.0 111.058 179.282 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.434 ' CE1' ' HB ' ' B' ' 98' ' ' VAL . 0.3 OUTLIER 65.98 -152.66 0.24 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.297 -179.466 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.434 ' HB ' ' CE1' ' B' ' 97' ' ' PHE . 21.8 t -145.19 117.06 2.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.754 0.312 . . . . 0.0 111.114 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -148.07 135.9 20.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.843 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 43.68 92.52 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.453 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -138.15 102.28 4.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.927 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.482 HG23 ' N ' ' A' ' 103' ' ' ASN . 31.5 m -125.92 -44.87 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.047 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.482 ' N ' HG23 ' A' ' 102' ' ' VAL . 56.4 m-80 -153.68 -46.49 0.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.959 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp 63.83 129.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.858 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.19 94.02 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.966 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.189 179.961 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.453 HG22 ' H ' ' B' ' 51' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.803 0.335 . . . . 0.0 111.088 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.453 ' H ' HG22 ' B' ' 50' ' ' THR . 7.0 mmt-85 -63.34 177.11 0.69 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.995 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' CB ' ' B' ' 55' ' ' THR . . . -61.47 -22.6 65.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.136 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.6 ' O ' HG21 ' A' ' 57' ' ' VAL . 14.4 m-70 63.58 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.528 HD23 HG13 ' A' ' 57' ' ' VAL . 0.8 OUTLIER -94.74 -68.05 0.82 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.864 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.665 ' CB ' ' HB1' ' B' ' 52' ' ' ALA . 97.7 m 22.16 -86.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.8 mt-10 -60.0 -68.3 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 0.0 111.452 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.587 HG21 ' O ' ' A' ' 53' ' ' HIS . 41.7 t -56.84 -21.74 14.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.658 -179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.691 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.9 pt-20 -70.32 -46.0 65.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' HG2' ' B' ' 58' ' ' GLU . 0.3 OUTLIER -68.39 -17.3 64.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.006 177.138 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.526 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 0.4 OUTLIER -73.74 -75.2 0.16 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.553 -179.806 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.3 mm? -60.38 -29.38 68.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.144 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.662 ' HB2' HD12 ' A' ' 61' ' ' LEU . 3.6 tt0 -66.35 -38.09 86.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' B' ' 59' ' ' SER . 6.2 ttt85 -66.88 -27.76 67.77 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -27.29 59.1 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.544 0.687 . . . . 0.0 109.626 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.441 ' OE1' HD11 ' A' ' 69' ' ' LEU . 8.5 tm-20 -78.25 -30.12 48.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.382 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 -31.15 69.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.669 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.42 -10.8 45.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.353 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.4 ' CZ ' HD12 ' A' ' 71' ' ' ILE . 97.2 m-85 63.56 143.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.814 0.34 . . . . 0.0 110.949 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.0 tp -93.49 -63.62 1.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.984 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 30.6 mt -146.83 33.55 0.93 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.855 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -89.71 -58.87 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.166 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.24 112.22 46.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.952 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.43 -160.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.527 2.151 . . . . 0.0 112.313 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -134.22 164.0 28.36 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -52.65 96.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.168 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 179.06 -38.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.259 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.9 tp 179.66 148.53 0.27 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.426 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' ASP . . . . . 0.49 ' OD2' HD11 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -116.97 104.68 11.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.077 0.465 . . . . 0.0 110.808 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.478 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 0.0 OUTLIER -68.42 -39.06 81.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.621 -179.429 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -62.03 -46.78 95.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.558 HD23 ' CD2' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -79.06 -25.54 43.13 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.0 -178.955 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 82' ' ' LYS . . . . . 0.478 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 0.0 OUTLIER -84.84 -18.43 34.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.354 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 32.6 mtm -107.84 -23.18 12.16 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' ASP . . . . . 0.549 ' CB ' HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -58.39 -74.83 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.727 0.299 . . . . 0.0 111.257 -179.52 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 85' ' ' SER . . . . . 0.452 ' C ' HD23 ' B' ' 86' ' ' LEU . 1.5 m -174.43 127.71 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.194 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.513 HD23 ' N ' ' B' ' 86' ' ' LEU . 0.4 OUTLIER -158.41 28.93 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.613 179.776 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -96.89 -15.45 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.284 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 65.4 m-20 -70.73 -12.01 61.3 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.077 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.644 HG21 ' HB ' ' A' ' 89' ' ' ILE . 11.2 mm -86.76 -57.65 4.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.582 ' O ' ' HB ' ' B' ' 94' ' ' THR . 40.0 tt0 -63.31 -19.19 64.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.187 177.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 91' ' ' ALA . . . . . 0.599 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -83.23 -68.63 0.69 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.345 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.435 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.3 tt -47.56 -28.33 2.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.959 0.409 . . . . 0.0 110.128 179.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.559 HD12 ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER -83.18 -40.5 19.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.679 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.599 HG22 ' HA ' ' B' ' 91' ' ' ALA . 4.0 t -69.1 -9.67 53.84 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.841 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.98 -33.54 3.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.128 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 0.7 OUTLIER -87.83 -8.02 56.46 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.008 0.432 . . . . 0.0 111.104 179.286 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.434 ' CE1' ' HB ' ' A' ' 98' ' ' VAL . 0.4 OUTLIER 66.01 -152.74 0.24 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.214 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.434 ' HB ' ' CE1' ' A' ' 97' ' ' PHE . 21.9 t -145.12 117.02 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 111.15 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -148.02 135.9 21.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.873 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 43.67 92.49 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.411 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -138.12 102.44 4.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.947 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.472 HG23 ' N ' ' B' ' 103' ' ' ASN . 31.3 m -125.92 -44.91 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.048 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 103' ' ' ASN . . . . . 0.472 ' N ' HG23 ' B' ' 102' ' ' VAL . 56.4 m-80 -153.7 -46.47 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.937 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 63.72 129.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.914 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.37 94.06 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.898 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.257 -0.877 . . . . 0.0 111.162 -179.988 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.834 0.35 . . . . 0.0 111.142 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.75 -49.57 2.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.956 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.55 -60.31 2.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.057 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.723 ' O ' HG22 ' B' ' 57' ' ' VAL . 0.0 OUTLIER 64.99 74.39 0.39 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.143 179.905 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.606 HD23 ' HB2' ' A' ' 58' ' ' GLU . 1.5 mt -147.14 -96.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.516 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 0.2 OUTLIER 37.82 -142.73 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.099 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.71 -64.17 0.19 Allowed 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.703 HG22 ' O ' ' B' ' 53' ' ' HIS . 34.0 t -50.45 -37.21 14.59 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.657 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.3 pt-20 -61.36 -48.09 82.9 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.471 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -66.27 -15.64 63.37 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.381 177.802 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.452 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 29.2 ttm-85 -72.96 -71.35 0.31 Allowed 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.554 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.69 HD13 HD22 ' A' ' 64' ' ' LEU . 4.4 mm? -64.58 -27.29 68.85 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.851 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.448 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 1.9 tt0 -68.58 -33.44 74.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.57 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.0 OUTLIER -81.4 -19.37 42.73 Favored 'General case' 0 C--O 1.231 0.102 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.452 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.69 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -82.98 -24.01 33.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.253 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' B' ' 65' ' ' GLU . 0.6 OUTLIER -93.93 -65.14 1.01 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.655 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.449 ' O ' ' CB ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.33 133.89 53.55 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.471 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.5 OUTLIER 83.4 -45.73 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.777 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.65 88.7 3.29 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.969 0.414 . . . . 0.0 110.669 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.07 161.2 38.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.738 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.63 -19.49 58.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.273 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.581 ' O ' HG22 ' A' ' 71' ' ' ILE . 15.7 mm -125.05 27.51 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.643 0.259 . . . . 0.0 111.633 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.435 ' CE2' ' HB2' ' A' ' 74' ' ' ARG . 5.1 p90 -58.04 137.29 84.03 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.006 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.468 2.112 . . . . 0.0 112.335 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.435 ' HB2' ' CE2' ' A' ' 72' ' ' PHE . 0.0 OUTLIER -169.06 -65.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -70.94 0.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 61.39 154.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.78 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 pp -150.11 26.64 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.136 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 62.56 69.52 0.6 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.935 0.397 . . . . 0.0 110.893 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 29.0 mtp -65.27 -49.16 70.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.692 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.421 HG22 HD11 ' B' ' 81' ' ' LEU . 2.0 mp -76.6 -41.19 34.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.727 HD12 HD12 ' B' ' 81' ' ' LEU . 1.0 OUTLIER -60.15 -30.15 69.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.661 179.665 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.45 -29.75 18.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.392 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.81 -24.24 63.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.769 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.6 96.63 10.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.5 m -54.06 109.92 0.54 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.179 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 pp -139.39 26.39 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.56 -21.88 13.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -7.01 49.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 0.0 111.105 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.696 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.6 mp -91.79 -54.05 7.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.44 ' HG3' HG21 ' B' ' 89' ' ' ILE . 0.0 OUTLIER -66.63 -20.88 66.09 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.2 178.014 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -56.83 3.16 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.265 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.522 HD23 HG11 ' A' ' 98' ' ' VAL . 32.8 tp -54.76 -24.09 20.91 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.694 ' HG ' HG12 ' A' ' 98' ' ' VAL . 11.2 mt -92.24 -39.53 11.48 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.544 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.65 -13.85 61.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.146 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.11 -40.89 0.46 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.422 -0.894 . . . . 0.0 113.345 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 96' ' ' LEU . 3.9 mm? -111.71 -0.44 16.0 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 30.4 p90 39.53 53.4 2.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.603 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.694 HG12 ' HG ' ' A' ' 93' ' ' LEU . 11.6 p -54.16 148.24 2.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.357 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.5 -65.95 0.94 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.968 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -177.01 -39.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.024 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -55.75 131.22 46.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.059 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.422 HG13 ' O ' ' A' ' 102' ' ' VAL . 12.0 p -135.13 126.07 45.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.014 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -82.69 142.53 31.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.85 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 60.58 95.42 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.97 177.43 5.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.888 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.122 -179.965 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.873 0.368 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.34 -50.29 5.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.888 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.76 -60.28 2.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.075 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.703 ' O ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 65.06 74.4 0.39 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.033 179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.591 HD23 ' HB2' ' B' ' 58' ' ' GLU . 1.5 mt -147.1 -96.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.5 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.52 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 0.2 OUTLIER 37.67 -142.77 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 179.077 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.67 -64.15 0.19 Allowed 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.723 HG22 ' O ' ' A' ' 53' ' ' HIS . 34.6 t -50.6 -37.14 15.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.779 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.667 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.3 pt-20 -61.28 -48.09 83.02 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.468 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 0.2 OUTLIER -66.33 -15.46 63.27 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.521 177.762 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.465 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 28.8 ttm-85 -73.01 -71.26 0.31 Allowed 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.63 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.694 HD13 HD22 ' B' ' 64' ' ' LEU . 4.4 mm? -64.53 -27.45 68.97 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.842 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.445 ' HB2' HD12 ' A' ' 61' ' ' LEU . 1.9 tt0 -68.53 -33.52 74.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.503 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.0 OUTLIER -81.49 -19.2 42.78 Favored 'General case' 0 C--O 1.231 0.109 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.616 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.694 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -83.01 -23.95 33.05 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.244 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -94.06 -65.15 1.01 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.599 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 67' ' ' LEU . 0.0 OUTLIER -64.4 133.97 53.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.214 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.465 HD13 ' O ' ' B' ' 67' ' ' LEU . 0.5 OUTLIER 83.33 -45.74 0.12 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.756 -179.328 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.68 88.48 3.23 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.867 0.365 . . . . 0.0 110.586 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.573 HD13 ' H ' ' B' ' 70' ' ' LEU . 0.2 OUTLIER -158.11 160.09 36.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.59 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.573 ' H ' HD13 ' B' ' 69' ' ' LEU . 14.7 mt -59.64 -19.56 50.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.273 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.581 HG22 ' O ' ' B' ' 71' ' ' ILE . 15.7 mm -124.98 27.53 2.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.595 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' PHE . . . . . 0.435 ' CE2' ' HB2' ' B' ' 74' ' ' ARG . 5.1 p90 -58.04 137.34 84.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.966 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.568 2.179 . . . . 0.0 112.283 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' ARG . . . . . 0.435 ' HB2' ' CE2' ' B' ' 72' ' ' PHE . 0.0 OUTLIER -168.96 -65.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.114 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -125.31 122.83 37.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.19 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 p30 -66.89 173.73 3.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.789 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp 177.56 -30.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.177 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 64.17 69.24 0.53 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.902 0.382 . . . . 0.0 110.696 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 29.1 mtp -65.16 -49.3 70.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.675 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.42 HG22 HD11 ' A' ' 81' ' ' LEU . 2.0 mp -76.43 -41.25 35.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.727 HD12 HD12 ' A' ' 81' ' ' LEU . 1.0 OUTLIER -60.15 -30.19 69.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.558 179.765 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.58 -29.7 18.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.296 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.76 -24.3 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.712 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.64 96.57 10.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.638 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 5.4 m -54.01 109.82 0.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.601 ' O ' HD12 ' B' ' 86' ' ' LEU . 3.2 pp -139.43 26.67 2.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.992 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.74 -21.92 13.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.922 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' B' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -6.97 49.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.061 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.694 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.6 mp -91.79 -54.03 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.414 ' HG3' HG21 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -66.61 -20.8 66.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.237 177.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.35 -56.69 3.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.247 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.498 HD23 HG11 ' B' ' 98' ' ' VAL . 33.4 tp -54.82 -24.1 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.97 0.414 . . . . 0.0 109.908 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.7 ' HG ' HG12 ' B' ' 98' ' ' VAL . 11.1 mt -92.28 -39.57 11.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.47 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.94 61.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.13 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.06 -40.84 0.47 Allowed Glycine 0 CA--C 1.519 0.3 0 C-N-CA 120.42 -0.895 . . . . 0.0 113.354 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.76 -0.45 15.95 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 30.0 p90 39.52 53.43 2.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.571 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.7 HG12 ' HG ' ' B' ' 93' ' ' LEU . 11.6 p -54.06 148.23 2.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.353 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.55 -65.93 0.95 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.939 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -177.02 -39.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.938 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -55.67 131.13 45.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.063 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.425 ' O ' HG13 ' B' ' 102' ' ' VAL . 12.0 p -135.06 125.99 45.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.043 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -82.59 142.53 31.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.833 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt 60.66 95.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.87 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.89 177.42 5.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.944 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.213 -0.898 . . . . 0.0 111.126 179.946 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.803 0.335 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -59.89 110.24 1.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.966 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.66 157.46 42.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.23 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.619 ' O ' HG21 ' B' ' 57' ' ' VAL . 3.1 m-70 -116.75 -66.49 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.63 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.865 HD23 ' OE1' ' A' ' 58' ' ' GLU . 5.0 mp -54.62 -81.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.426 HG22 ' O ' ' A' ' 54' ' ' LEU . 13.2 t 42.72 -151.19 0.03 OUTLIER 'General case' 0 C--O 1.24 0.576 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 178.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 15.1 mt-10 -38.02 -41.46 0.56 Allowed 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.575 -178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.61 HG21 ' O ' ' B' ' 53' ' ' HIS . 51.6 t -64.44 -42.74 96.16 Favored 'Isoleucine or valine' 0 C--O 1.251 1.143 0 CA-C-O 121.362 0.601 . . . . 0.0 110.922 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.942 ' O ' HD23 ' B' ' 61' ' ' LEU . 1.1 pt-20 -59.04 -54.5 46.34 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.503 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 94.0 p -61.67 -17.56 56.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.657 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.464 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.8 -71.49 0.22 Allowed 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.871 -179.115 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.959 HD23 ' O ' ' B' ' 58' ' ' GLU . 0.0 OUTLIER -67.8 -19.97 65.14 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.787 -179.335 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.406 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.21 77.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.901 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.6 mtp85 -85.78 -18.66 32.34 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.215 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.803 HD13 ' CD1' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -75.85 -34.22 60.06 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.144 0.497 . . . . 0.0 110.407 179.639 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.551 ' N ' HD23 ' A' ' 64' ' ' LEU . 0.5 OUTLIER -96.49 -28.84 14.22 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.129 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.03 42.31 3.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.127 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.31 119.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.26 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HB2' ' CD2' ' B' ' 68' ' ' PHE . 4.0 t80 -151.4 124.0 8.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.985 0.422 . . . . 0.0 110.971 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tp -175.23 -39.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.07 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -103.82 26.01 9.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 21.6 mt -114.01 -24.87 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.173 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 63.45 123.36 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.732 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -84.17 87.11 1.19 Allowed 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.683 2.255 . . . . 0.0 112.654 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.7 mtp-105 56.47 34.12 23.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.243 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.85 104.54 14.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 75.4 -76.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.494 HD22 HD11 ' B' ' 80' ' ' ILE . 6.6 mp 53.95 68.2 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.026 0.441 . . . . 0.0 110.88 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -114.3 -19.02 11.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.674 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.1 -40.81 74.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.742 0.306 . . . . 0.0 111.045 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mm -67.3 -44.11 87.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.117 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.831 HD12 HD12 ' B' ' 81' ' ' LEU . 3.7 mp -65.27 -24.3 67.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.921 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.07 -26.81 22.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.937 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 39.7 mtp -85.17 -20.28 30.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.101 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.593 ' HB3' HD21 ' B' ' 81' ' ' LEU . 3.9 t0 -99.5 28.02 4.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.77 0.319 . . . . 0.0 110.98 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 168.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.061 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.481 ' CA ' HD13 ' A' ' 89' ' ' ILE . 2.5 mt -176.09 -40.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.897 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.92 -30.62 22.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.811 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.687 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -71.06 -9.93 58.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.169 179.72 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.707 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.4 mp -91.65 -55.97 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.54 -20.9 65.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.524 -0.762 . . . . 0.0 108.982 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.2 -49.98 6.91 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.883 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.687 HD12 ' O ' ' A' ' 88' ' ' ASP . 4.4 mt -53.97 -26.75 27.43 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 3.8 mm? -91.9 -36.88 13.22 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.997 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.19 -14.82 57.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.964 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.47 -29.79 1.26 Allowed Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.498 -0.858 . . . . 0.0 113.21 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.649 ' O ' HG23 ' A' ' 98' ' ' VAL . 1.0 OUTLIER -100.12 2.87 43.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.962 0.381 . . . . 0.0 111.956 -179.521 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.423 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 24.5 p90 -38.89 137.54 0.65 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.679 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 96' ' ' LEU . 21.7 t -141.98 140.69 29.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.991 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -72.86 130.49 40.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.968 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -134.86 150.61 50.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.915 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -57.21 5.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.803 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.8 m -80.21 138.8 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.151 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -97.95 -34.62 10.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.887 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -110.2 113.33 25.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -148.3 31.36 0.83 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.904 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.128 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.797 0.332 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 33.9 mtt85 -149.66 60.42 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.826 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.61 157.32 42.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.203 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.61 ' O ' HG21 ' A' ' 57' ' ' VAL . 3.1 m-70 -116.71 -66.27 1.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.725 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.861 HD23 ' OE1' ' B' ' 58' ' ' GLU . 5.0 mp -54.72 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.726 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.433 HG22 ' O ' ' B' ' 54' ' ' LEU . 13.3 t 42.81 -151.25 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.405 ' N ' HG23 ' B' ' 55' ' ' THR . 14.8 mt-10 -38.04 -41.37 0.56 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.613 -178.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.619 HG21 ' O ' ' A' ' 53' ' ' HIS . 52.5 t -64.46 -42.87 96.52 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.297 0.57 . . . . 0.0 110.798 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.959 ' O ' HD23 ' A' ' 61' ' ' LEU . 1.1 pt-20 -58.97 -54.65 44.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.509 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 94.1 p -61.47 -17.73 55.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.728 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.65 -71.63 0.21 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.857 -179.132 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.942 HD23 ' O ' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -67.69 -19.97 65.23 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.834 -179.281 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.44 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.25 77.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.886 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.6 mtp85 -85.7 -18.69 32.38 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.169 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.803 HD13 ' CD1' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -75.88 -34.16 59.99 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.14 0.495 . . . . 0.0 110.365 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.549 ' N ' HD23 ' B' ' 64' ' ' LEU . 0.5 OUTLIER -96.64 -28.78 14.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.115 179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 65.83 42.47 3.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.22 118.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.465 ' CD2' ' HB2' ' A' ' 68' ' ' PHE . 4.0 t80 -151.28 123.64 8.34 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.024 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -174.75 -39.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.075 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mt -104.16 26.14 9.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.159 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.424 ' HB ' ' CE1' ' B' ' 68' ' ' PHE . 21.4 mt -113.98 -24.82 3.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.246 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 63.54 123.28 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.696 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -84.3 86.92 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.778 2.318 . . . . 0.0 112.552 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.0 mtp-105 53.88 24.45 4.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.805 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -83.79 -73.55 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.342 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.91 88.16 2.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.937 0.398 . . . . 0.0 110.755 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.63 67.97 0.92 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -105.64 -19.8 13.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -40.75 75.29 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.494 HD11 HD22 ' A' ' 77' ' ' LEU . 34.9 mm -67.34 -44.2 87.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.018 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.831 HD12 HD12 ' A' ' 81' ' ' LEU . 3.6 mp -65.33 -24.09 67.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.19 -26.82 22.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.98 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 39.8 mtp -85.1 -20.37 30.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.15 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' ASP . . . . . 0.582 ' HB3' HD21 ' A' ' 81' ' ' LEU . 3.8 t0 -99.48 28.13 4.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.073 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t 57.45 168.05 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.48 ' CA ' HD13 ' B' ' 89' ' ' ILE . 0.5 OUTLIER -176.06 -40.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.926 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.75 -30.74 22.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.91 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.681 ' O ' HD12 ' B' ' 92' ' ' LEU . 0.2 OUTLIER -70.89 -10.13 59.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.688 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.5 mp -91.57 -56.01 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -62.52 -20.9 65.08 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.045 177.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 -49.92 6.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.0 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.681 HD12 ' O ' ' B' ' 88' ' ' ASP . 4.4 mt -54.01 -26.74 27.77 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 3.8 mm? -91.84 -36.92 13.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.013 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.12 -14.87 57.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.986 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.41 -29.96 1.24 Allowed Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.199 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.648 ' O ' HG23 ' B' ' 98' ' ' VAL . 1.0 OUTLIER -100.04 2.87 43.76 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.583 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 24.4 p90 -38.82 137.5 0.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.643 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.648 HG23 ' O ' ' B' ' 96' ' ' LEU . 21.7 t -142.0 140.7 29.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.929 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -72.89 130.38 40.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.893 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -134.82 150.6 50.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.903 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -57.33 5.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.739 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 11.9 m -80.22 138.93 18.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.095 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -98.09 -34.35 10.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.938 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.5 mtpm? -110.46 113.25 25.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.798 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -148.22 31.32 0.84 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.954 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.04 179.968 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.812 0.339 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.6 ttt85 -123.84 -73.24 0.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.927 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -136.24 28.51 3.1 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.251 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -126.62 85.38 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.776 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.59 HD12 HG13 ' B' ' 57' ' ' VAL . 19.6 tp -172.7 -100.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.017 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.493 ' C ' ' O ' ' A' ' 54' ' ' LEU . 38.4 m 6.35 -72.75 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -59.96 -68.52 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.997 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.593 HG13 HD12 ' B' ' 54' ' ' LEU . 24.5 t -55.53 -48.56 77.2 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.603 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.2 pt-20 -51.72 -47.29 64.06 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.387 0.613 . . . . 0.0 109.469 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.414 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 4.9 t -67.61 -19.51 65.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.577 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.445 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -69.21 -68.53 0.4 Allowed 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.466 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.668 ' HG ' ' HB2' ' B' ' 62' ' ' GLU . 3.6 mm? -62.91 -42.46 99.8 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.802 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.643 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 69.7 tt0 -50.8 -35.96 34.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.255 177.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.45 -26.59 46.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.913 0.387 . . . . 0.0 110.035 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -27.16 68.3 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.3 0.571 . . . . 0.0 109.742 179.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 66' ' ' GLN . 25.2 tt0 -99.56 -21.23 15.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.882 178.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 65' ' ' GLU . 17.3 pt20 50.53 35.26 10.92 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.482 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.445 ' O ' ' CB ' ' A' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 11.0 7.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.925 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.817 ' CE1' HD22 ' B' ' 69' ' ' LEU . 0.4 OUTLIER 158.58 137.69 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.471 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.877 ' HG ' HG22 ' A' ' 71' ' ' ILE . 0.7 OUTLIER -66.42 -165.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.34 179.458 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.74 -15.51 58.74 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.877 HG22 ' HG ' ' A' ' 69' ' ' LEU . 0.7 OUTLIER -57.18 -28.86 30.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.716 0.293 . . . . 0.0 111.539 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.19 92.95 5.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.164 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.75 -7.6 21.04 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.579 2.186 . . . . 0.0 112.663 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 65.9 49.71 1.61 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.351 . . . . 0.0 110.918 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -176.27 -51.04 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -108.59 135.07 50.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.961 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.401 ' O ' HD12 ' A' ' 77' ' ' LEU . 1.6 pp -109.36 30.12 6.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.96 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 30.54 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -49.72 57.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.415 HG13 HD12 ' A' ' 71' ' ' ILE . 37.9 mm -61.72 -45.51 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.989 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 mt -66.11 -30.4 70.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.524 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -74.86 -28.97 60.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.855 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.03 -73.93 0.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.577 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.39 116.4 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.624 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.554 ' HB2' HD21 ' B' ' 86' ' ' LEU . 0.7 OUTLIER 75.49 -161.93 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.777 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 64.92 26.07 12.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.751 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -148.94 -40.88 0.15 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.912 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.22 -8.3 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.881 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.534 HG21 ' HB ' ' B' ' 89' ' ' ILE . 13.0 mm -89.36 -56.87 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.524 ' O ' ' HB ' ' A' ' 94' ' ' THR . 2.5 tm-20 -64.89 -19.88 66.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.493 178.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.787 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.48 -58.74 2.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.641 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 25.5 tp -55.85 -24.27 35.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.289 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.572 ' HG ' HG12 ' A' ' 98' ' ' VAL . 1.0 OUTLIER -92.38 -39.79 11.25 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.066 179.668 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.787 HG22 ' HA ' ' A' ' 91' ' ' ALA . 11.4 t -69.94 -11.49 60.91 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.898 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.33 -35.85 1.06 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.753 -0.737 . . . . 0.0 113.19 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 96' ' ' LEU . 0.2 OUTLIER -95.71 -5.42 42.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 117.015 0.408 . . . . 0.0 112.015 -179.565 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.426 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 25.6 p90 37.26 93.97 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.033 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.572 HG12 ' HG ' ' A' ' 93' ' ' LEU . 12.2 p -105.03 113.93 43.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.184 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.44 154.14 18.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.98 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -159.57 143.79 14.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.886 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -103.13 136.6 42.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.009 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.42 HG23 ' N ' ' A' ' 103' ' ' ASN . 5.9 m -148.7 -47.19 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.42 ' N ' HG23 ' A' ' 102' ' ' VAL . 12.8 m-20 -92.85 128.47 38.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.862 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.81 139.45 46.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.852 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.8 t0 57.7 101.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.18 -179.944 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.861 0.362 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.04 57.89 0.66 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.689 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -133.74 28.28 3.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.288 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -126.54 85.43 2.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.593 HD12 HG13 ' A' ' 57' ' ' VAL . 19.7 tp -172.81 -100.37 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.028 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.483 ' C ' ' O ' ' B' ' 54' ' ' LEU . 38.9 m 6.46 -72.87 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -59.95 -68.53 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.007 -178.923 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.59 HG13 HD12 ' A' ' 54' ' ' LEU . 25.0 t -55.68 -48.17 78.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.714 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.622 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 pt-20 -52.01 -47.28 65.04 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.425 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 4.8 t -67.41 -19.56 65.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.666 178.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.452 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -69.26 -68.59 0.39 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.426 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.643 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 3.6 mm? -62.9 -42.43 99.78 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 119.377 -0.929 . . . . 0.0 108.742 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.668 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 69.7 tt0 -50.85 -35.83 34.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.249 177.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.6 -26.57 45.43 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.918 0.39 . . . . 0.0 110.014 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -27.2 68.37 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.336 0.588 . . . . 0.0 109.723 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.423 ' O ' ' CG ' ' B' ' 66' ' ' GLN . 25.3 tt0 -99.54 -21.35 15.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.837 178.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' B' ' 65' ' ' GLU . 17.3 pt20 50.53 35.32 11.07 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.47 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.45 ' O ' ' CB ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 10.8 7.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.958 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.548 ' CE1' HD22 ' A' ' 69' ' ' LEU . 0.3 OUTLIER 158.78 138.61 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.632 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.817 HD22 ' CE1' ' A' ' 68' ' ' PHE . 2.4 tp -66.06 -166.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.439 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 15.8 mt -63.7 -15.44 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.345 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.441 HD12 HG13 ' B' ' 80' ' ' ILE . 0.7 OUTLIER -57.24 -28.66 30.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.715 0.293 . . . . 0.0 111.549 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.28 93.09 5.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.169 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.82 -7.63 21.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.62 2.213 . . . . 0.0 112.695 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 65.74 49.27 1.75 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.922 0.391 . . . . 0.0 110.836 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -170.64 -61.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.835 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -105.35 139.47 39.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.754 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.03 34.16 3.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.5 30.41 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -49.75 56.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.441 HG13 HD12 ' B' ' 71' ' ' ILE . 38.0 mm -61.72 -45.49 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mt -66.05 -30.39 70.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.585 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -75.0 -28.82 60.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.04 -73.92 0.43 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.651 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.36 116.35 10.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.597 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 75.67 -162.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.692 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' ' 85' ' ' SER . 1.1 mm? 64.85 26.18 12.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.847 0.356 . . . . 0.0 110.723 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -148.96 -40.91 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.802 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.27 -8.16 51.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.884 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.534 ' HB ' HG21 ' A' ' 89' ' ' ILE . 12.9 mm -89.37 -56.96 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.521 ' O ' ' HB ' ' B' ' 94' ' ' THR . 2.4 tm-20 -64.93 -19.91 66.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.432 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 91' ' ' ALA . . . . . 0.78 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.33 -58.69 2.49 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.78 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 25.8 tp -55.8 -24.36 35.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.288 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.586 ' HG ' HG12 ' B' ' 98' ' ' VAL . 1.0 OUTLIER -92.25 -39.89 11.27 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.08 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.78 HG22 ' HA ' ' B' ' 91' ' ' ALA . 11.5 t -69.97 -11.47 60.9 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.895 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.4 -35.89 1.05 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.106 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.427 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -95.62 -5.39 42.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 117.162 0.481 . . . . 0.0 112.105 -179.648 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.431 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 25.9 p90 37.25 94.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.13 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.586 HG12 ' HG ' ' B' ' 93' ' ' LEU . 12.1 p -105.13 113.85 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.19 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.33 154.28 18.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.927 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -159.7 143.75 14.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -103.13 136.45 42.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.408 HG23 ' N ' ' B' ' 103' ' ' ASN . 5.8 m -148.53 -47.17 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.09 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 103' ' ' ASN . . . . . 0.408 ' N ' HG23 ' B' ' 102' ' ' VAL . 12.5 m-20 -92.92 128.58 38.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.805 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.86 138.78 46.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 1.8 t0 58.26 101.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.929 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.109 -179.99 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 74.2 p . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.707 0.289 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.8 mtm180 -167.31 -49.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.023 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -165.14 79.42 0.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.328 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -157.27 27.46 0.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -101.13 -0.46 36.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.59 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.518 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -56.32 -53.41 57.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.79 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.14 -42.05 63.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.75 ' HB ' HG11 ' B' ' 57' ' ' VAL . 2.9 t -62.59 -41.1 90.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.628 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.594 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 2.4 mt-10 -56.61 -64.1 0.98 Allowed 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.6 m -52.88 -20.51 3.37 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.118 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.01 -73.25 0.15 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.159 -179.31 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.874 ' CD1' HD13 ' A' ' 64' ' ' LEU . 3.6 mm? -61.83 -24.42 66.88 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.145 -1.022 . . . . 0.0 110.208 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.28 -37.19 86.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.49 177.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -20.39 53.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.522 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.874 HD13 ' CD1' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -74.47 -32.07 62.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.46 0.647 . . . . 0.0 110.386 179.404 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.574 ' N ' HD23 ' A' ' 64' ' ' LEU . 3.3 mm-40 -92.81 -23.71 18.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.623 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -58.74 -39.03 79.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.017 0.437 . . . . 0.0 110.366 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.554 ' O ' HD23 ' A' ' 67' ' ' LEU . 9.1 tt -76.46 -11.42 59.88 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.969 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 31.5 t80 76.57 130.93 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.91 0.386 . . . . 0.0 111.123 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -145.15 61.04 1.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.737 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.7 52.47 13.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.149 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.408 ' CD1' ' HG2' ' B' ' 66' ' ' GLN . 6.5 tp -99.43 -41.08 9.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.097 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.407 ' N ' HG23 ' A' ' 71' ' ' ILE . 2.9 t80 -78.57 113.52 35.31 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.836 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.1 134.36 59.73 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.361 2.041 . . . . 0.0 112.255 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.6 mtm180 -156.38 89.01 1.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -73.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -95.51 121.57 37.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.226 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp 53.9 100.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.128 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.623 ' CB ' HD21 ' A' ' 81' ' ' LEU . 13.1 m-20 -75.69 96.3 3.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 28.5 mtt -62.5 -25.82 68.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.901 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.03 -55.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.403 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.711 HD12 HD22 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -81.52 -15.68 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -179.874 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.37 -25.98 38.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.814 0.34 . . . . 0.0 110.744 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.54 -22.86 12.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.89 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.04 -68.46 0.44 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.746 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 p -147.88 -92.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.96 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.711 HD22 HD12 ' A' ' 81' ' ' LEU . 12.8 tp 44.78 29.78 0.47 Allowed 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 120.783 0.325 . . . . 0.0 111.414 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.77 -33.42 1.82 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.361 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.77 -10.29 57.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.668 0.27 . . . . 0.0 111.242 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 21.3 mm -88.71 -53.89 8.76 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.473 ' O ' ' HB ' ' A' ' 94' ' ' THR . 33.2 tt0 -67.49 -16.81 64.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.184 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.825 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -88.02 -47.86 8.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.212 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 10.4 mt -64.08 -24.19 67.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.159 0.504 . . . . 0.0 109.756 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.521 HD13 ' O ' ' A' ' 97' ' ' PHE . 1.3 mm? -91.26 -36.85 13.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.795 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.825 HG22 ' HA ' ' A' ' 91' ' ' ALA . 9.0 t -75.51 -13.02 60.35 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.0 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.65 -31.11 1.86 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.251 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.96 -0.11 12.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 117.151 0.475 . . . . 0.0 112.144 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.542 ' HD2' HG23 ' A' ' 98' ' ' VAL . 0.1 OUTLIER 36.14 -92.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.279 179.485 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.542 HG23 ' HD2' ' A' ' 97' ' ' PHE . 21.6 t -57.57 155.6 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.252 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.419 ' N ' HG12 ' A' ' 98' ' ' VAL . 3.0 mt-30 -177.64 90.17 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.847 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -128.1 10.55 6.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.29 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 54.65 -172.76 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.82 0.343 . . . . 0.0 111.144 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 10.8 p -114.88 148.06 17.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.935 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 32.0 m120 60.33 -179.38 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.757 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -153.78 -49.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.691 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -58.84 -47.01 86.36 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.088 179.904 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.899 0.38 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.13 -57.69 1.99 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.783 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.99 78.99 0.46 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.024 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -157.28 27.46 0.3 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.986 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.737 HD22 ' O ' ' B' ' 54' ' ' LEU . 0.0 OUTLIER -101.25 -0.44 35.81 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.605 -179.876 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.522 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -56.33 -53.38 57.94 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.204 0.526 . . . . 0.0 110.778 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.16 -42.13 63.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.662 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.75 HG11 ' HB ' ' A' ' 57' ' ' VAL . 2.9 t -62.65 -40.96 90.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.646 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 2.4 mt-10 -56.66 -64.03 1.0 Allowed 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 43.5 m -52.93 -20.45 3.38 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.138 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.456 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.13 -73.14 0.15 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.156 -179.331 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.883 HD13 HD13 ' B' ' 64' ' ' LEU . 3.6 mm? -61.9 -24.34 66.89 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.2 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -65.5 -37.05 85.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -20.4 53.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.566 178.189 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.883 HD13 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -74.63 -31.95 62.14 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.36 0.6 . . . . 0.0 110.328 179.506 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.583 ' N ' HD23 ' B' ' 64' ' ' LEU . 3.3 mm-40 -92.81 -23.62 18.78 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.718 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 0.408 ' HG2' ' CD1' ' A' ' 71' ' ' ILE . 7.6 mt-30 -58.77 -39.16 80.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.309 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.573 ' O ' HD23 ' B' ' 67' ' ' LEU . 9.2 tt -76.43 -11.41 59.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.025 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' B' ' 67' ' ' LEU . 31.3 t80 76.48 130.99 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.877 0.37 . . . . 0.0 111.216 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.48 60.98 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.0 52.46 12.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.5 tp -99.37 -41.07 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.248 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -78.48 113.54 35.26 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.905 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.05 134.17 58.64 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.416 2.078 . . . . 0.0 112.266 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -155.85 87.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.798 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -163.67 102.33 0.92 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.468 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 66.45 127.08 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.471 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.74 69.56 0.5 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.02 0.438 . . . . 0.0 110.704 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' ASP . . . . . 0.626 ' CB ' HD21 ' B' ' 81' ' ' LEU . 12.9 m-20 -72.02 97.25 1.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.643 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 28.2 mtt -62.64 -25.7 68.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.1 -55.77 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.346 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.626 HD21 ' CB ' ' B' ' 78' ' ' ASP . 0.4 OUTLIER -81.71 -15.53 54.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.484 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.41 -26.01 38.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.788 0.327 . . . . 0.0 110.75 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.53 -22.82 12.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.0 -68.57 0.43 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.715 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 p -147.86 -92.2 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.91 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.507 HD22 HD12 ' B' ' 81' ' ' LEU . 9.1 tp 44.82 29.76 0.48 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.79 0.328 . . . . 0.0 111.358 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.92 -33.35 1.79 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.387 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.72 -10.33 57.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.34 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 20.9 mm -88.48 -53.9 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.456 ' O ' ' HB ' ' B' ' 94' ' ' THR . 33.2 tt0 -67.65 -16.78 64.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.185 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 91' ' ' ALA . . . . . 0.814 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -88.0 -47.73 8.31 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.332 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.21 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.135 0.493 . . . . 0.0 109.713 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.531 HD13 ' O ' ' B' ' 97' ' ' PHE . 1.3 mm? -91.29 -36.95 13.58 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.773 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.814 HG22 ' HA ' ' B' ' 91' ' ' ALA . 9.1 t -75.44 -13.1 60.37 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.033 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.59 -31.04 1.88 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.398 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.9 -0.11 12.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 117.154 0.477 . . . . 0.0 112.273 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.531 ' O ' HD13 ' B' ' 93' ' ' LEU . 0.1 OUTLIER 36.05 -92.87 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.272 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.528 HG23 ' HD2' ' B' ' 97' ' ' PHE . 21.5 t -57.63 155.58 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.844 0.354 . . . . 0.0 111.308 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.426 ' N ' HG12 ' B' ' 98' ' ' VAL . 3.0 mt-30 -177.58 90.27 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -128.14 10.5 6.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.333 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 54.76 -172.86 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.796 0.332 . . . . 0.0 111.007 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.8 p -114.82 148.12 17.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.926 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 32.3 m120 60.33 -179.62 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.882 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -153.46 -49.7 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.718 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -58.85 -47.12 86.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.77 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.114 179.999 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.761 0.315 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.26 172.24 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.883 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.49 -76.16 0.52 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.117 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.535 ' C ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -144.87 136.97 25.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.034 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.596 HD12 ' N ' ' A' ' 54' ' ' LEU . 5.0 mp -110.5 -57.52 2.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.618 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.423 ' C ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -21.04 -55.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 1.7 mm-40 -58.68 -50.84 72.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.266 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.619 HG12 ' N ' ' B' ' 58' ' ' GLU . 6.1 t -63.92 -53.81 39.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.39 -179.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.786 ' HB2' HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.58 -62.39 1.68 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.576 ' N ' HD22 ' B' ' 61' ' ' LEU . 29.9 t -48.72 -28.03 3.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.64 177.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 8.7 tpt180 -60.74 -63.86 1.15 Allowed 'General case' 0 C--O 1.242 0.694 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.889 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.925 HD23 ' HB2' ' B' ' 62' ' ' GLU . 1.0 OUTLIER -63.03 -18.22 63.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 118.1 -1.44 . . . . 0.0 109.71 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.908 ' HB2' HD23 ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.34 -37.66 87.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.722 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -68.91 -31.6 70.62 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -63.21 -30.15 71.35 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.086 177.67 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.448 ' N ' HD23 ' A' ' 64' ' ' LEU . 0.6 OUTLIER -80.18 -31.44 38.81 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.049 179.159 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -55.74 -35.93 66.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.56 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.01 -29.99 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.524 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.58 102.96 0.78 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.772 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.1 -72.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.26 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.45 ' O ' HG22 ' A' ' 71' ' ' ILE . 4.9 mt -140.48 53.48 1.62 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.85 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 70' ' ' LEU . 7.1 tt 42.84 32.18 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.54 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.15 67.49 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.2 163.91 1.42 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.523 2.149 . . . . 0.0 112.35 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.21 89.34 7.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.404 ' HB3' HD13 ' A' ' 77' ' ' LEU . 4.2 tp10 -159.96 152.08 20.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -80.87 90.18 5.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.404 HD13 ' HB3' ' A' ' 75' ' ' GLU . 6.9 mp -118.91 175.36 5.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.793 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.434 ' HB2' ' HB2' ' A' ' 81' ' ' LEU . 7.0 p-10 -137.08 59.71 1.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -45.92 77.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.015 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -57.16 -39.79 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.861 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.803 HD12 HD12 ' B' ' 81' ' ' LEU . 9.3 mp -71.38 -27.91 63.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.788 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.16 -23.3 44.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 16.4 mtp -95.96 -21.11 18.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.247 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.57 -2.74 37.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.412 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.55 143.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.946 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.531 HD22 HD23 ' A' ' 81' ' ' LEU . 9.7 tp -149.62 26.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.958 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -116.14 -15.96 11.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.287 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.569 ' O ' HD23 ' A' ' 92' ' ' LEU . 67.4 m-20 -71.08 -10.06 59.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.649 0.262 . . . . 0.0 111.22 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.732 ' O ' HD12 ' A' ' 93' ' ' LEU . 20.2 mm -89.68 -55.36 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.501 ' O ' ' HB ' ' A' ' 94' ' ' THR . 20.0 tt0 -66.23 -17.58 64.83 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.275 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.774 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.94 -55.35 3.8 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.555 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.569 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.2 mm? -58.98 -23.44 61.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.115 0.483 . . . . 0.0 110.051 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.732 HD12 ' O ' ' A' ' 89' ' ' ILE . 0.4 OUTLIER -91.43 -40.92 11.15 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.046 179.774 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.774 HG22 ' HA ' ' A' ' 91' ' ' ALA . 10.5 t -71.01 -11.73 61.13 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.226 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.71 -33.64 1.27 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.122 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.01 -2.86 33.4 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.41 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 17.6 p90 40.35 79.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.688 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.6 t -88.21 104.57 14.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.109 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -106.13 -68.89 0.85 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.983 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.59 155.34 36.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.927 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -115.35 179.35 3.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.902 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 23.1 t -76.1 -41.71 37.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.076 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -154.52 93.5 1.59 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -133.86 -57.8 0.87 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.944 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -161.11 112.43 1.8 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.939 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.067 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.872 0.368 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 -177.0 76.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.762 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.33 -76.21 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.243 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.544 ' C ' HD12 ' B' ' 54' ' ' LEU . 0.0 OUTLIER -144.85 137.02 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.043 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.588 ' N ' HD12 ' B' ' 54' ' ' LEU . 5.0 mp -110.54 -57.51 2.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.641 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.434 ' C ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -20.98 -55.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 179.977 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 1.7 mm-40 -58.7 -50.86 72.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.841 0.353 . . . . 0.0 111.287 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.618 HG12 ' N ' ' A' ' 58' ' ' GLU . 6.1 t -63.8 -53.84 39.43 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.767 ' HB2' HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.56 -62.4 1.68 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.592 ' N ' HD22 ' A' ' 61' ' ' LEU . 30.1 t -48.73 -28.14 3.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.567 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.527 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 8.7 tpt180 -60.6 -63.83 1.16 Allowed 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.991 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.908 HD23 ' HB2' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -63.18 -18.07 63.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.111 -1.436 . . . . 0.0 109.808 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.925 ' HB2' HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -65.38 -37.67 87.71 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 175.616 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -68.96 -31.52 70.45 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.574 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -63.16 -30.29 71.47 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.05 177.653 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.452 ' N ' HD23 ' B' ' 64' ' ' LEU . 0.6 OUTLIER -80.21 -31.32 38.68 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.638 -1.165 . . . . 0.0 110.125 179.147 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -55.86 -35.87 66.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.563 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -29.87 63.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.541 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.64 103.2 0.83 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.647 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 43.7 tp -54.26 -72.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.23 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.441 ' O ' HG22 ' B' ' 71' ' ' ILE . 4.8 mt -140.36 53.46 1.63 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.907 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.441 HG22 ' O ' ' B' ' 70' ' ' LEU . 7.1 tt 42.88 32.1 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.651 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.11 67.58 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.927 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.27 163.92 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.596 2.197 . . . . 0.0 112.28 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.15 89.32 7.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -159.98 151.51 19.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.75 90.07 5.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.58 175.96 5.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' ASP . . . . . 0.429 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 6.9 p-10 -137.33 59.69 1.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.857 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -45.83 77.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.091 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.7 mm -57.14 -39.83 69.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.803 HD12 HD12 ' A' ' 81' ' ' LEU . 9.3 mp -71.32 -27.99 63.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.753 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.1 -23.38 44.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.162 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 16.3 mtp -95.93 -21.13 18.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.186 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.5 -2.83 37.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.378 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.53 144.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.829 0.347 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.434 HD23 ' N ' ' B' ' 86' ' ' LEU . 2.2 pt? -149.8 26.02 0.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.952 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -115.92 -16.13 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.276 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.556 ' O ' HD23 ' B' ' 92' ' ' LEU . 67.7 m-20 -70.99 -10.08 59.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.736 0.303 . . . . 0.0 111.261 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.742 ' O ' HD12 ' B' ' 93' ' ' LEU . 20.1 mm -89.63 -55.42 6.3 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.481 ' O ' ' HB ' ' B' ' 94' ' ' THR . 20.0 tt0 -66.13 -17.78 64.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.217 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 91' ' ' ALA . . . . . 0.794 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.92 -55.33 3.81 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.553 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.556 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.2 mm? -59.05 -23.44 62.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.742 HD12 ' O ' ' B' ' 89' ' ' ILE . 0.4 OUTLIER -91.48 -40.8 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.968 179.811 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.794 HG22 ' HA ' ' B' ' 91' ' ' ALA . 10.6 t -71.16 -11.7 61.08 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.138 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.73 -33.72 1.26 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.756 -0.735 . . . . 0.0 113.044 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.07 -2.8 33.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 117.002 0.401 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.411 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 17.6 p90 40.46 79.55 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.671 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.5 t -88.14 104.51 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.163 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -106.12 -69.0 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.925 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.51 155.37 35.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.92 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -115.37 179.29 4.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.787 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 23.0 t -76.03 -41.71 38.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.12 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -154.62 93.52 1.59 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.85 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -133.86 -57.76 0.87 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.965 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -161.11 112.33 1.79 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.897 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.13 179.937 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.482 HG22 ' H ' ' A' ' 51' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.829 0.347 . . . . 0.0 111.187 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.482 ' H ' HG22 ' A' ' 50' ' ' THR . 4.7 ptp180 -61.33 131.18 49.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.074 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.57 120.24 8.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.831 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.569 ' HB3' HG22 ' B' ' 57' ' ' VAL . 0.2 OUTLIER -145.49 76.61 1.48 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.096 -179.493 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.452 HD23 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -177.65 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 116.719 -0.218 . . . . 0.0 111.13 -179.623 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.47 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.2 m 24.8 -85.3 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.435 ' CB ' ' CD2' ' B' ' 53' ' ' HIS . 4.0 mm-40 -62.74 -68.03 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.893 0.378 . . . . 0.0 111.744 -178.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.562 HG22 ' HB3' ' B' ' 53' ' ' HIS . 1.9 t -55.94 -44.55 78.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.289 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.714 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.1 pt-20 -52.98 -48.19 67.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.452 0.644 . . . . 0.0 109.452 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.48 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 27.8 t -66.39 -20.16 65.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.636 178.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 2.2 tpm_? -70.01 -71.73 0.23 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.832 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.845 ' CD1' HD22 ' A' ' 64' ' ' LEU . 3.5 mm? -61.21 -38.77 87.77 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.245 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.559 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 8.0 tt0 -53.41 -39.44 64.32 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.795 176.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.1 OUTLIER -70.25 -28.54 65.32 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.865 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.845 HD22 ' CD1' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.35 68.92 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.466 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 68' ' ' PHE . 30.0 tt0 -88.63 -25.48 22.4 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.355 178.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.27 -76.73 0.06 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.924 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.36 42.09 1.87 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.422 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.563 ' CD2' HD21 ' B' ' 64' ' ' LEU . 31.7 p90 -39.46 104.84 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.988 0.423 . . . . 0.0 111.546 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.91 -66.69 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.789 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 71.3 mt -150.27 -79.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.989 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.92 24.65 4.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.378 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.96 91.02 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.011 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.25 108.51 2.0 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.531 2.154 . . . . 0.0 112.304 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.04 146.89 32.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 55.97 177.72 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.078 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -125.12 37.45 4.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.88 35.38 1.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.856 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.21 20.33 15.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.99 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.15 -28.69 66.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 110.679 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 26.9 mm -79.46 -45.72 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.862 ' HB2' HD23 ' B' ' 81' ' ' LEU . 0.5 OUTLIER -69.43 -24.65 63.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.191 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.27 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.913 0.387 . . . . 0.0 110.891 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 44.4 mtp -57.98 -25.39 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.258 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.03 -59.02 0.45 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.035 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 m 64.53 -163.42 0.26 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.801 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.503 HD23 HD12 ' B' ' 86' ' ' LEU . 1.9 mt 70.41 30.28 3.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.33 -53.07 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.699 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.5 m-20 -70.5 -11.43 60.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.919 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.63 ' O ' HD13 ' A' ' 93' ' ' LEU . 26.4 mm -90.3 -52.06 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.615 ' HA ' HD22 ' B' ' 93' ' ' LEU . 1.5 tt0 -66.02 -17.95 65.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.033 177.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.773 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.89 -53.6 4.67 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.583 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 6.1 mp -61.13 -21.22 63.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.054 0.454 . . . . 0.0 110.156 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.63 HD13 ' O ' ' A' ' 89' ' ' ILE . 7.5 mp -94.52 -38.45 10.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.862 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.773 HG22 ' HA ' ' A' ' 91' ' ' ALA . 12.3 t -72.28 -13.47 61.51 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.909 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.36 -32.32 1.06 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.146 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.472 ' O ' ' CG ' ' A' ' 97' ' ' PHE . 0.4 OUTLIER -115.67 5.59 14.31 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.518 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.472 ' CG ' ' O ' ' A' ' 96' ' ' LEU . 39.0 p90 46.22 -145.21 0.21 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.355 -179.218 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 99' ' ' GLN . 12.4 p -80.03 158.25 4.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.855 0.359 . . . . 0.0 111.166 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.48 ' N ' HG22 ' A' ' 98' ' ' VAL . 6.7 tt0 63.03 144.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.573 ' HB2' HG12 ' A' ' 102' ' ' VAL . 1.7 p30 -110.38 -33.57 6.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.906 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.79 34.7 19.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.841 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.573 HG12 ' HB2' ' A' ' 100' ' ' ASP . 11.1 p -136.59 158.48 37.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.143 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.49 ' N ' HG22 ' A' ' 102' ' ' VAL . 12.3 m-80 -65.46 107.66 1.74 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.911 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.52 142.15 48.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.912 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -170.89 165.57 7.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.855 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.298 -0.858 . . . . 0.0 111.116 179.927 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.568 HG22 ' O ' ' B' ' 50' ' ' THR . 31.9 m . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.673 0.273 . . . . 0.0 111.19 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -175.34 53.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.089 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.29 119.83 7.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.855 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.562 ' HB3' HG22 ' A' ' 57' ' ' VAL . 0.2 OUTLIER -145.32 76.71 1.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.989 -179.476 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.457 HD23 ' H ' ' B' ' 55' ' ' THR . 0.5 OUTLIER -177.72 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.151 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.476 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.3 m 24.93 -85.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.44 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 4.0 mm-40 -62.84 -67.97 0.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.873 0.368 . . . . 0.0 111.705 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 53' ' ' HIS . 1.9 t -55.9 -44.71 78.83 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.177 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.702 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.1 pt-20 -52.9 -48.23 67.36 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.429 0.633 . . . . 0.0 109.49 179.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.49 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 28.0 t -66.29 -20.24 66.05 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.61 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -69.97 -71.71 0.23 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.891 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.837 ' CD1' HD22 ' B' ' 64' ' ' LEU . 3.5 mm? -61.3 -38.7 87.75 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.427 -0.909 . . . . 0.0 109.169 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.551 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 8.0 tt0 -53.56 -39.32 64.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.765 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.1 OUTLIER -70.26 -28.59 65.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.837 HD22 ' CD1' ' B' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.43 68.97 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.508 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.449 ' HG2' ' HA ' ' B' ' 68' ' ' PHE . 29.6 tt0 -88.43 -25.65 22.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.45 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -76.83 0.06 Allowed 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.815 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.43 42.21 1.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.35 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.556 ' CD2' HD21 ' A' ' 64' ' ' LEU . 31.8 p90 -39.43 104.73 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.859 0.361 . . . . 0.0 111.593 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.744 HD23 ' HG ' ' B' ' 70' ' ' LEU . 8.0 tt -145.91 -66.32 0.3 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.891 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.744 ' HG ' HD23 ' B' ' 69' ' ' LEU . 71.7 mt -150.49 -79.43 0.12 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.88 24.6 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.316 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.98 90.96 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.007 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -69.36 108.57 2.03 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.358 2.039 . . . . 0.0 112.273 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.98 146.92 32.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.963 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -57.95 88.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 p30 -131.07 23.38 4.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.82 89.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.227 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -113.9 20.09 16.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.83 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.2 -28.74 66.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.657 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 26.6 mm -79.28 -45.94 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.858 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.862 HD23 ' HB2' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -69.26 -24.66 64.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.29 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.24 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 44.6 mtp -57.94 -25.47 60.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.226 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.05 -59.11 0.45 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.781 0.324 . . . . 0.0 111.019 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 m 64.68 -163.48 0.26 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.829 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.503 HD12 HD23 ' A' ' 86' ' ' LEU . 0.4 OUTLIER 70.34 30.21 3.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.08 -53.04 0.91 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.728 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.5 m-20 -70.56 -11.42 60.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.881 0.372 . . . . 0.0 110.934 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.635 ' O ' HD13 ' B' ' 93' ' ' LEU . 26.5 mm -90.3 -52.0 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.606 ' HA ' HD22 ' A' ' 93' ' ' LEU . 1.5 tt0 -66.02 -17.87 64.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.086 177.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 91' ' ' ALA . . . . . 0.81 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.92 -53.66 4.63 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.588 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 6.1 mp -61.02 -21.35 63.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.423 . . . . 0.0 110.0 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.635 HD13 ' O ' ' B' ' 89' ' ' ILE . 7.5 mp -94.62 -38.33 10.9 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.81 HG22 ' HA ' ' B' ' 91' ' ' ALA . 12.4 t -72.29 -13.43 61.5 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.889 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.32 -32.36 1.06 Allowed Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.151 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.478 ' O ' ' CG ' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -115.64 5.59 14.34 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.478 ' CG ' ' O ' ' B' ' 96' ' ' LEU . 39.0 p90 46.34 -145.28 0.22 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.327 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.479 HG22 ' N ' ' B' ' 99' ' ' GLN . 12.5 p -79.92 158.19 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.814 0.34 . . . . 0.0 111.22 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.479 ' N ' HG22 ' B' ' 98' ' ' VAL . 6.6 tt0 63.07 144.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.881 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 100' ' ' ASP . . . . . 0.587 ' HB2' HG12 ' B' ' 102' ' ' VAL . 1.7 p30 -110.46 -33.44 6.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.874 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.78 34.62 19.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.84 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.587 HG12 ' HB2' ' B' ' 100' ' ' ASP . 11.0 p -136.55 158.46 37.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.07 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 103' ' ' ASN . . . . . 0.481 ' N ' HG22 ' B' ' 102' ' ' VAL . 12.4 m-80 -65.47 107.66 1.75 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 17.3 tttt -72.55 142.34 48.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.888 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -170.99 165.48 7.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.945 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.959 -179.957 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 120.937 0.398 . . . . 0.0 111.078 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.6 ptt85 -142.37 179.01 7.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.68 127.55 10.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.451 ' ND1' ' CE1' ' B' ' 53' ' ' HIS . 0.1 OUTLIER -62.06 83.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.454 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.93 HD12 HG22 ' B' ' 57' ' ' VAL . 2.3 tp 179.79 -33.55 0.01 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.656 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.568 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 5.1 m -45.23 -80.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -35.02 -65.44 0.22 Allowed 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.944 HG22 HD12 ' B' ' 54' ' ' LEU . 4.3 t -52.86 -28.99 14.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.234 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.673 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.7 pt-20 -64.92 -48.75 73.02 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.424 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 53.1 p -64.54 -18.61 64.99 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.501 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -75.61 0.12 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.078 -179.709 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.846 HD13 HD22 ' A' ' 64' ' ' LEU . 3.6 mm? -59.97 -29.72 68.62 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.032 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.677 ' HB2' HD12 ' B' ' 61' ' ' LEU . 19.6 tt0 -62.89 -39.5 94.7 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.081 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.56 -15.55 58.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.754 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.846 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -85.64 -24.28 27.16 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.421 -179.547 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.511 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -104.46 -21.9 13.39 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.78 -179.573 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.595 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -84.43 2.01 42.71 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.264 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.46 HD23 ' CD2' ' A' ' 68' ' ' PHE . 6.0 tp -114.09 -35.13 5.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 110.916 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.46 ' CD2' HD23 ' A' ' 67' ' ' LEU . 46.9 m-85 -141.61 166.91 23.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.971 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.9 mt 58.95 55.73 4.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.053 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.595 HD11 ' HA ' ' A' ' 66' ' ' GLN . 10.0 mt -129.19 -85.36 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.56 17.38 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.605 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.82 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.886 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.83 118.0 5.21 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.402 2.068 . . . . 0.0 112.339 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -161.86 162.27 29.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.808 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -144.54 133.21 22.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.915 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -177.64 -46.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.887 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 64.32 126.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.055 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.18 46.48 7.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.017 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 27.8 mtp -70.07 -41.18 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.749 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.945 HG22 HD23 ' B' ' 81' ' ' LEU . 12.5 mm -63.5 -51.33 71.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.834 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 1.075 HD22 HD22 ' B' ' 81' ' ' LEU . 0.9 OUTLIER -66.14 -29.03 69.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.854 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.9 -30.0 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.992 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.3 -21.6 24.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.05 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.83 102.72 15.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.901 0.382 . . . . 0.0 110.78 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.59 87.03 1.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.698 ' HB3' HD23 ' B' ' 86' ' ' LEU . 0.4 OUTLIER -114.48 -17.98 11.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -71.4 -8.89 56.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.526 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 68.3 m-20 -73.1 -9.85 59.17 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.798 0.333 . . . . 0.0 110.995 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.554 HG22 HG22 ' B' ' 89' ' ' ILE . 7.4 mm -88.6 -53.0 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 94' ' ' THR . 1.6 tt0 -67.02 -20.7 65.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.911 178.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.25 -67.43 0.8 Allowed 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.409 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.534 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.1 tt -52.05 -23.74 5.69 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.02 0.438 . . . . 0.0 110.389 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.903 HD12 HD12 ' B' ' 93' ' ' LEU . 8.1 tt -87.77 -38.43 15.77 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.532 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.405 ' CB ' ' O ' ' A' ' 90' ' ' GLU . 3.8 m -72.76 -10.89 60.32 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.87 -30.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.477 -0.868 . . . . 0.0 113.788 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.06 4.88 3.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 93' ' ' LEU . 22.7 p90 40.3 70.57 0.23 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.575 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.844 ' HB ' HD11 ' B' ' 93' ' ' LEU . 13.8 p 42.79 46.42 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.863 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -67.62 0.39 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.913 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -112.69 176.7 4.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.921 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -154.17 130.0 10.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.814 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.9 p -153.64 147.24 14.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.086 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.28 106.84 10.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.963 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 40.9 mttp 61.68 152.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.836 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.93 86.99 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.832 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.055 -179.968 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.861 0.362 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 19.3 mtt85 -92.96 -29.16 16.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.883 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.51 127.87 10.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.259 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.451 ' CE1' ' ND1' ' A' ' 53' ' ' HIS . 0.1 OUTLIER -62.04 83.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.53 179.667 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.944 HD12 HG22 ' A' ' 57' ' ' VAL . 2.3 tp 179.84 -33.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.755 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.569 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 5.0 m -45.15 -80.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -34.91 -65.53 0.21 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.93 HG22 HD12 ' A' ' 54' ' ' LEU . 4.3 t -52.88 -28.94 14.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.165 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.656 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.7 pt-20 -64.98 -48.62 73.34 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 53.0 p -64.67 -18.55 65.08 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.512 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -75.54 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.067 -179.744 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.854 HD13 HD22 ' B' ' 64' ' ' LEU . 3.6 mm? -60.02 -29.71 68.68 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.948 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.658 ' HB2' HD12 ' A' ' 61' ' ' LEU . 19.6 tt0 -62.79 -39.67 94.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.132 177.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.54 -15.48 58.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.716 178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.854 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -85.68 -24.4 27.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.906 0.384 . . . . 0.0 111.339 -179.591 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.517 ' O ' HD11 ' B' ' 70' ' ' LEU . 0.1 OUTLIER -104.47 -21.83 13.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 0.611 ' HA ' HD11 ' B' ' 70' ' ' LEU . 0.0 OUTLIER -84.53 2.2 42.27 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.298 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.465 HD23 ' CD2' ' B' ' 68' ' ' PHE . 6.0 tp -114.07 -35.18 5.14 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.833 0.349 . . . . 0.0 110.95 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.465 ' CD2' HD23 ' B' ' 67' ' ' LEU . 46.7 m-85 -141.58 166.9 23.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.035 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 mp 58.95 55.56 4.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.093 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.611 HD11 ' HA ' ' B' ' 66' ' ' GLN . 10.0 mt -128.98 -85.41 0.56 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.817 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.57 17.5 4.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.586 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.93 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.726 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.85 117.87 5.11 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.508 2.139 . . . . 0.0 112.349 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -161.31 160.39 29.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.826 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -119.44 -165.17 1.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.922 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.59 101.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.77 164.15 18.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.77 46.49 8.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.816 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 27.9 mtp -69.92 -41.28 74.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.719 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.903 HG22 HD23 ' A' ' 81' ' ' LEU . 12.4 mm -63.44 -51.35 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 1.075 HD22 HD22 ' A' ' 81' ' ' LEU . 0.9 OUTLIER -66.17 -28.95 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.873 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.85 -30.18 62.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.972 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.24 -21.59 24.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.064 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.78 102.8 15.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.865 0.364 . . . . 0.0 110.744 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.69 87.12 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.01 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.698 HD23 ' HB3' ' A' ' 86' ' ' LEU . 1.9 mp -114.41 -18.19 11.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.269 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -71.36 -8.82 56.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.523 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 68.4 m-20 -73.02 -9.97 59.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.803 0.335 . . . . 0.0 111.04 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.554 HG22 HG22 ' A' ' 89' ' ' ILE . 7.4 mm -88.64 -53.03 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.401 ' O ' ' CB ' ' B' ' 94' ' ' THR . 1.6 tt0 -66.96 -20.71 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.947 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.18 -67.44 0.79 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.529 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.537 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.1 tt -51.96 -23.91 5.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.979 0.419 . . . . 0.0 110.309 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.903 HD12 HD12 ' A' ' 93' ' ' LEU . 8.1 tt -87.72 -38.38 15.86 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.554 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.401 ' CB ' ' O ' ' B' ' 90' ' ' GLU . 3.8 m -72.73 -10.91 60.35 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.155 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.92 -30.23 1.66 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.433 -0.889 . . . . 0.0 113.645 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.09 4.97 3.01 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' B' ' 93' ' ' LEU . 22.8 p90 40.26 70.48 0.24 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.878 0.37 . . . . 0.0 111.618 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.851 ' HB ' HD11 ' A' ' 93' ' ' LEU . 13.7 p 42.99 46.36 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.81 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -67.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.9 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -112.79 176.79 4.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -154.28 129.9 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.875 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.0 p -153.55 147.3 14.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.1 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.33 106.8 10.11 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.917 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.88 151.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.835 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.07 87.09 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.049 -179.958 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.728 0.299 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.52 166.02 11.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.851 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -115.52 85.49 2.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.159 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 179.05 57.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.634 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.665 ' CD2' HG13 ' B' ' 57' ' ' VAL . 0.3 OUTLIER -136.35 -51.49 0.7 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.873 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 54' ' ' LEU . 92.3 m 15.2 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.477 ' N ' ' O ' ' A' ' 54' ' ' LEU . 8.4 pt-20 -64.96 -55.95 16.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.632 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.739 ' HB ' HG11 ' B' ' 57' ' ' VAL . 4.6 t -59.6 -50.0 81.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-O 120.524 0.202 . . . . 0.0 111.454 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.782 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -53.11 -49.67 66.03 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.5 t -61.65 -21.43 64.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.589 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.454 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 0.7 OUTLIER -71.26 -73.17 0.19 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.311 -179.337 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.773 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -60.85 -27.1 67.85 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.129 -178.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.473 ' HB2' HD12 ' B' ' 61' ' ' LEU . 1.8 tt0 -66.83 -38.81 87.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.376 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.762 ' HG2' HD21 ' A' ' 67' ' ' LEU . 45.2 ttp180 -83.54 -9.18 59.11 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.78 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.953 HD22 ' O ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -91.83 -27.41 17.98 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.03 0.443 . . . . 0.0 111.254 -179.079 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.841 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 1.4 tp10 -113.5 -48.3 2.95 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 8.4 tt0 -47.0 -43.82 19.71 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.762 HD21 ' HG2' ' A' ' 63' ' ' ARG . 3.3 pp -97.49 22.7 8.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.775 0.321 . . . . 0.0 111.038 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -135.65 96.3 3.42 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 110.649 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.998 HD21 HD23 ' B' ' 69' ' ' LEU . 0.2 OUTLIER -154.97 158.7 39.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.619 -179.649 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.752 ' H ' HD13 ' A' ' 69' ' ' LEU . 31.3 mt -49.74 -28.18 5.8 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.826 0.345 . . . . 0.0 111.064 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 34.1 mm -67.32 -14.33 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.275 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.21 106.12 0.59 Allowed Pre-proline 0 C--N 1.332 -0.183 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.8 127.0 13.93 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.403 2.069 . . . . 0.0 112.336 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.27 -40.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.864 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -131.49 177.28 7.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -110.78 75.91 0.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.014 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.25 -39.66 62.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.77 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.537 ' CB ' HD21 ' A' ' 81' ' ' LEU . 50.4 m-20 -146.69 93.77 2.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.868 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.16 -24.48 64.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.081 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.0 mm -63.31 -56.3 18.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.365 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.537 HD21 ' CB ' ' A' ' 78' ' ' ASP . 0.4 OUTLIER -82.89 -10.45 58.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.599 -179.657 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -88.19 -27.3 21.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.55 0.214 . . . . 0.0 111.263 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -16.25 12.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.536 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.57 -66.3 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.795 0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.59 -171.32 0.19 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.187 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -168.08 -43.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.786 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.876 ' CB ' ' HB2' ' A' ' 91' ' ' ALA . 38.1 mtt180 -107.89 -67.94 0.93 Allowed 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.826 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.6 m-20 21.53 -59.39 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.873 ' N ' ' O ' ' A' ' 87' ' ' ARG . 19.9 mm -84.27 -58.24 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 94' ' ' THR . 3.4 tm-20 -66.13 -12.06 53.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.347 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.876 ' HB2' ' CB ' ' A' ' 87' ' ' ARG . . . -87.22 -57.09 3.09 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.172 0.511 . . . . 0.0 110.054 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 0.1 OUTLIER -60.26 -21.28 61.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.869 178.884 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.676 HD23 ' O ' ' A' ' 97' ' ' PHE . 5.1 mt -93.34 -35.43 13.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.736 HG22 ' HA ' ' A' ' 91' ' ' ALA . 12.8 t -75.61 -12.26 60.18 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.66 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.03 -29.44 1.81 Allowed Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.206 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.61 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -118.88 2.17 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.441 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.676 ' O ' HD23 ' A' ' 93' ' ' LEU . 0.1 OUTLIER 37.67 -93.1 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.167 179.638 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.457 ' O ' HD23 ' A' ' 96' ' ' LEU . 20.1 t -76.79 138.24 20.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.779 0.323 . . . . 0.0 111.238 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -125.69 162.85 24.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.691 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.91 116.15 30.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.873 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -137.73 161.77 35.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.987 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.441 HG22 ' N ' ' A' ' 103' ' ' ASN . 9.9 p -167.34 155.68 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.441 ' N ' HG22 ' A' ' 102' ' ' VAL . 7.2 p30 -101.93 160.51 14.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.916 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.5 tttp 49.53 -174.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.075 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.57 -176.43 0.6 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.925 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.326 -0.845 . . . . 0.0 111.061 179.931 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.483 HG22 ' HB2' ' B' ' 53' ' ' HIS . 14.1 t . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.895 0.378 . . . . 0.0 110.986 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 41.6 ttp85 -53.53 -57.32 11.12 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.264 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -116.58 85.49 2.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.361 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.483 ' HB2' HG22 ' B' ' 50' ' ' THR . 0.2 OUTLIER 179.02 57.45 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.837 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.683 ' CD2' HG13 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -136.24 -51.47 0.71 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.9 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.449 ' C ' ' O ' ' B' ' 54' ' ' LEU . 92.2 m 15.16 -79.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' B' ' 54' ' ' LEU . 8.4 pt-20 -65.06 -55.85 16.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.601 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.739 HG11 ' HB ' ' A' ' 57' ' ' VAL . 4.5 t -59.59 -50.0 81.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-O 120.538 0.208 . . . . 0.0 111.461 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.773 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -53.06 -49.68 65.87 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.347 0.594 . . . . 0.0 109.522 179.073 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 12.4 t -61.8 -21.34 64.51 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.511 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.442 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 0.7 OUTLIER -71.38 -73.2 0.19 Allowed 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.417 -0.811 . . . . 0.0 112.267 -179.301 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.782 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -60.84 -26.91 67.69 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.207 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' B' ' 66' ' ' GLN . 1.8 tt0 -66.89 -38.82 86.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.317 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.782 ' HG2' HD21 ' B' ' 67' ' ' LEU . 45.0 ttp180 -83.43 -9.35 59.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.808 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.972 ' O ' HD22 ' B' ' 64' ' ' LEU . 0.0 OUTLIER -91.82 -27.42 17.99 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.01 0.433 . . . . 0.0 111.271 -179.032 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.841 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.4 tp10 -113.53 -48.24 2.95 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 66' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' B' ' 62' ' ' GLU . 8.4 tt0 -46.99 -43.69 19.55 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.782 HD21 ' HG2' ' B' ' 63' ' ' ARG . 3.3 pp -97.56 22.71 8.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.724 0.297 . . . . 0.0 111.003 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -135.6 97.15 3.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.861 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.998 HD23 HD21 ' A' ' 69' ' ' LEU . 0.3 OUTLIER -156.12 160.93 40.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.814 179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 31.9 mt -51.12 -28.46 10.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.695 ' HB ' HD13 ' B' ' 69' ' ' LEU . 33.9 mm -67.34 -14.17 17.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.391 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.18 106.02 0.57 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.236 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.66 127.05 14.11 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.41 2.074 . . . . 0.0 112.387 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.16 -39.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.855 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.99 -176.32 3.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -78.52 -69.92 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.94 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.6 mt 68.82 -68.1 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' ASP . . . . . 0.541 ' CB ' HD21 ' B' ' 81' ' ' LEU . 50.3 m-20 -147.19 94.05 2.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.25 -24.51 64.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.09 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 39.3 mm -63.38 -56.17 18.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.315 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.541 HD21 ' CB ' ' B' ' 78' ' ' ASP . 0.4 OUTLIER -82.97 -10.5 58.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.689 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -88.07 -27.33 22.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.685 0.279 . . . . 0.0 111.404 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.51 -16.18 12.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.621 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.5 -66.36 0.29 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.777 0.322 . . . . 0.0 111.012 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.7 -171.26 0.19 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.974 0.416 . . . . 0.0 111.026 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -168.15 -43.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.763 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.877 ' CB ' ' HB2' ' B' ' 91' ' ' ALA . 38.7 mtt180 -108.23 -67.9 0.94 Allowed 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.769 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.6 m-20 21.71 -59.54 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.872 ' N ' ' O ' ' B' ' 87' ' ' ARG . 20.4 mm -84.33 -58.22 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.507 ' O ' ' HB ' ' B' ' 94' ' ' THR . 3.4 tm-20 -66.0 -12.19 53.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.392 177.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 91' ' ' ALA . . . . . 0.877 ' HB2' ' CB ' ' B' ' 87' ' ' ARG . . . -87.15 -57.03 3.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.138 0.494 . . . . 0.0 110.084 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.422 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 0.1 OUTLIER -60.15 -21.29 61.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.985 178.78 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.675 HD23 ' O ' ' B' ' 97' ' ' PHE . 5.1 mt -93.32 -35.52 13.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.929 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.713 HG22 ' HA ' ' B' ' 91' ' ' ALA . 12.6 t -75.53 -12.26 60.19 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.752 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.04 -29.55 1.78 Allowed Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.722 -0.752 . . . . 0.0 113.137 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.62 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.6 OUTLIER -118.78 2.16 11.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.492 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.675 ' O ' HD23 ' B' ' 93' ' ' LEU . 0.1 OUTLIER 37.78 -93.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.022 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.461 ' O ' HD23 ' B' ' 96' ' ' LEU . 20.0 t -76.85 138.29 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 0.0 111.27 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -125.71 162.81 24.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.597 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.76 116.1 30.16 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.007 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -137.82 161.76 35.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.999 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.437 HG22 ' N ' ' B' ' 103' ' ' ASN . 10.0 p -167.33 155.49 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.021 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 103' ' ' ASN . . . . . 0.437 ' N ' HG22 ' B' ' 102' ' ' VAL . 7.2 p30 -101.52 161.0 13.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.942 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' B' ' 103' ' ' ASN . 0.0 OUTLIER 48.26 -173.35 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.291 -179.704 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.81 -176.19 0.56 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.924 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.077 -179.972 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.973 0.416 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.1 tpp180 -113.87 -31.06 6.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.134 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -145.72 29.06 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.375 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 59.76 111.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.875 0.369 . . . . 0.0 110.889 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.964 HD23 HG22 ' B' ' 57' ' ' VAL . 1.3 mt -119.15 -17.15 9.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.811 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.521 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 92.7 m -53.6 -84.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.29 -60.93 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.951 HG22 HD23 ' B' ' 54' ' ' LEU . 3.3 t -56.73 -39.33 63.06 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 120.918 0.389 . . . . 0.0 111.842 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.81 ' O ' HD13 ' B' ' 61' ' ' LEU . 1.3 pt-20 -58.52 -55.06 39.96 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.478 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 31.4 t -63.53 -14.91 55.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.623 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.523 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 1.7 ttt180 -70.83 -74.03 0.16 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.493 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 1.11 HD23 HD22 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -66.17 -20.02 66.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 117.772 -1.571 . . . . 0.0 109.702 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.943 ' CB ' HD22 ' B' ' 61' ' ' LEU . 11.0 tm-20 -64.4 -38.5 91.25 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 175.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -70.91 -29.35 65.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.863 177.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 1.11 HD22 HD23 ' A' ' 61' ' ' LEU . 0.1 OUTLIER -67.47 -28.39 67.82 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.804 178.411 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -83.71 -31.28 26.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.249 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -29.08 68.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.28 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' A' ' 68' ' ' PHE . 7.3 mt -84.06 -12.18 55.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.019 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.464 ' CE1' ' CG2' ' A' ' 71' ' ' ILE . 83.8 t80 65.54 95.22 0.06 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.873 0.368 . . . . 0.0 110.775 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.497 HD13 ' H ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -155.22 157.42 37.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.967 -179.936 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.497 ' H ' HD13 ' A' ' 69' ' ' LEU . 1.0 OUTLIER 54.08 21.65 3.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.68 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.614 HD13 ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -120.96 -48.61 2.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.672 0.273 . . . . 0.0 110.827 179.715 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.496 ' N ' HG23 ' A' ' 71' ' ' ILE . 4.6 m-85 55.84 165.57 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.861 0.363 . . . . 0.0 111.262 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -78.19 126.07 7.53 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.642 2.228 . . . . 0.0 112.263 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.06 -30.58 11.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.993 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -91.98 166.71 12.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.949 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.466 ' OD1' HG23 ' B' ' 80' ' ' ILE . 19.0 t70 -107.82 -43.12 4.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 mp 63.49 140.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.574 ' HA ' HD21 ' A' ' 81' ' ' LEU . 1.5 t0 -109.84 -26.29 9.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.46 -29.1 61.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.073 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -65.14 -66.47 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.881 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.824 ' O ' HD13 ' A' ' 86' ' ' LEU . 0.6 OUTLIER -60.22 -19.35 54.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 179.935 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -81.23 -31.53 33.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.802 0.334 . . . . 0.0 111.027 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.4 ptm -92.6 -13.44 29.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.573 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.18 51.73 2.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 111.423 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.0 m 44.92 93.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.573 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.824 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -115.9 -28.67 6.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.166 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.34 -11.5 59.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.494 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.547 ' O ' HD12 ' A' ' 92' ' ' LEU . 3.2 m-20 -71.48 -10.43 59.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.718 0.294 . . . . 0.0 111.295 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.8 mm -89.58 -55.52 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.42 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.545 ' HG3' HD11 ' B' ' 93' ' ' LEU . 38.1 tt0 -66.32 -17.91 65.04 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.303 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.83 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -88.24 -53.42 4.71 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.453 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.547 HD12 ' O ' ' A' ' 88' ' ' ASP . 16.8 mt -58.76 -25.22 62.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.973 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.548 HD11 ' HG3' ' B' ' 90' ' ' GLU . 0.8 OUTLIER -91.99 -39.38 11.7 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.067 179.845 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.83 HG22 ' HA ' ' A' ' 91' ' ' ALA . 10.7 t -70.94 -11.78 61.16 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.008 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.76 -34.76 1.23 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.958 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.402 ' C ' ' CD1' ' A' ' 97' ' ' PHE . 0.1 OUTLIER -98.36 -2.27 39.68 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.945 0.372 . . . . 0.0 111.914 -179.672 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.402 ' CD1' ' C ' ' A' ' 96' ' ' LEU . 3.4 p90 40.5 -125.94 0.45 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.277 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.478 HG22 ' N ' ' A' ' 99' ' ' GLN . 11.8 p -103.23 157.88 4.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.803 0.335 . . . . 0.0 111.229 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.478 ' N ' HG22 ' A' ' 98' ' ' VAL . 2.7 mt-30 -104.73 101.42 11.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -70.18 102.63 2.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -154.68 151.83 29.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.8 m -110.1 -29.87 2.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -134.86 -179.79 5.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.93 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.06 136.05 33.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.846 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.92 153.19 18.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.925 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.078 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.779 0.323 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -135.62 49.36 2.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.985 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -145.09 28.81 1.21 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.206 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 59.93 111.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.867 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.951 HD23 HG22 ' A' ' 57' ' ' VAL . 1.3 mt -119.21 -17.29 8.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.796 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.524 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 92.5 m -53.53 -84.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.32 -60.97 0.17 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.964 HG22 HD23 ' A' ' 54' ' ' LEU . 3.2 t -56.62 -39.33 62.16 Favored 'Isoleucine or valine' 0 C--O 1.25 1.08 0 CA-C-O 120.939 0.399 . . . . 0.0 111.93 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.809 ' O ' HD13 ' A' ' 61' ' ' LEU . 1.2 pt-20 -58.58 -55.06 39.89 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.485 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 31.2 t -63.49 -15.01 56.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.618 177.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.517 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 1.7 ttt180 -70.62 -74.19 0.15 Allowed 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.495 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 1.046 HD23 HD22 ' B' ' 64' ' ' LEU . 0.1 OUTLIER -66.15 -19.97 66.0 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 117.703 -1.599 . . . . 0.0 109.651 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.969 ' HB2' HD22 ' A' ' 61' ' ' LEU . 11.1 tm-20 -64.45 -38.5 91.23 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -70.92 -29.21 65.19 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.909 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 1.046 HD22 HD23 ' B' ' 61' ' ' LEU . 0.1 OUTLIER -67.54 -28.46 67.83 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.697 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -83.71 -31.35 26.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.093 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -29.09 68.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.262 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' B' ' 68' ' ' PHE . 7.3 mt -83.95 -12.18 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.657 ' O ' HD22 ' B' ' 69' ' ' LEU . 83.7 t80 65.58 95.14 0.06 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.801 0.334 . . . . 0.0 110.713 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.657 HD22 ' O ' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -155.25 157.32 37.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 54.15 21.78 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.588 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.609 HD13 ' O ' ' B' ' 71' ' ' ILE . 0.0 OUTLIER -120.97 -48.64 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.611 0.243 . . . . 0.0 110.839 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 72' ' ' PHE . . . . . 0.49 ' N ' HG23 ' B' ' 71' ' ' ILE . 4.6 m-85 55.77 165.66 0.06 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.277 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.34 126.16 7.47 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.541 2.161 . . . . 0.0 112.268 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.05 -30.63 11.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.997 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -92.1 167.24 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -108.26 -42.96 4.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.926 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.2 mt 63.52 140.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.985 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' ASP . . . . . 0.574 ' HA ' HD21 ' B' ' 81' ' ' LEU . 1.5 t0 -109.89 -26.28 9.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -29.21 61.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.016 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.466 HG23 ' OD1' ' A' ' 76' ' ' ASP . 35.6 mm -64.98 -66.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.973 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.574 HD21 ' HA ' ' B' ' 78' ' ' ASP . 0.6 OUTLIER -60.3 -19.39 54.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.135 179.925 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -80.96 -31.69 34.77 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.823 0.344 . . . . 0.0 111.121 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 25.5 ptm -92.63 -13.38 29.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.568 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.25 51.75 2.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.781 0.324 . . . . 0.0 111.39 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 6.1 m 45.01 93.05 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.484 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tp -115.82 -28.79 6.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.044 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.36 -11.41 59.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.548 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.548 ' O ' HD12 ' B' ' 92' ' ' LEU . 3.1 m-20 -71.51 -10.43 59.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 0.0 111.309 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 17.2 mm -89.66 -55.59 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.454 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.548 ' HG3' HD11 ' A' ' 93' ' ' LEU . 38.2 tt0 -66.11 -18.05 65.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.278 177.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 91' ' ' ALA . . . . . 0.814 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -88.23 -53.39 4.72 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.507 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.548 HD12 ' O ' ' B' ' 88' ' ' ASP . 16.8 mt -58.77 -25.19 62.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.076 0.465 . . . . 0.0 110.083 178.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.545 HD11 ' HG3' ' A' ' 90' ' ' GLU . 0.8 OUTLIER -91.93 -39.45 11.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.117 179.778 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.814 HG22 ' HA ' ' B' ' 91' ' ' ALA . 10.8 t -70.91 -11.88 61.22 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.942 179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.67 -34.73 1.24 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.002 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.406 ' C ' ' CD1' ' B' ' 97' ' ' PHE . 0.1 OUTLIER -98.44 -2.09 39.85 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.758 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' B' ' 96' ' ' LEU . 3.4 p90 40.54 -125.93 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.304 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.476 HG22 ' N ' ' B' ' 99' ' ' GLN . 11.8 p -103.26 157.88 4.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.476 ' N ' HG22 ' B' ' 98' ' ' VAL . 2.7 mt-30 -104.8 101.62 11.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.845 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -70.4 102.61 2.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.879 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -154.6 151.91 29.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 m -110.12 -29.94 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.103 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -134.83 -179.75 5.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.87 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.11 136.06 33.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.876 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.9 153.14 18.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.956 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.117 -179.961 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.821 0.343 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -122.35 77.77 1.44 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.445 ' O ' ' CG ' ' A' ' 53' ' ' HIS . . . -133.97 -117.29 0.19 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.905 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 52' ' ' ALA . 21.2 p80 43.58 30.06 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.753 0.311 . . . . 0.0 111.456 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.67 -32.59 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 1.7 m -75.59 -41.25 55.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.441 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.8 -40.97 63.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.928 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.578 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 2.8 t -71.89 -40.94 69.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 120.975 0.417 . . . . 0.0 110.839 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.774 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 24.5 pt-20 -62.63 -48.15 80.64 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.434 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 3.5 m -63.42 -22.67 67.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.309 177.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 2.7 mtt-85 -68.54 -71.68 0.21 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.671 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.0 mm? -61.37 -24.79 66.73 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.844 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.493 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.05 -37.02 86.21 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.69 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -31.13 68.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.866 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.518 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -68.48 -27.77 66.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.293 178.369 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.47 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 2.2 tm-20 -80.88 -31.58 35.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.473 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.02 -49.47 65.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.76 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.659 HD12 ' O ' ' A' ' 68' ' ' PHE . 3.7 pp -63.0 -26.98 69.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.916 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.659 ' O ' HD12 ' A' ' 67' ' ' LEU . 2.1 m-85 64.68 160.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.934 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.94 88.22 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.795 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 51.57 51.67 16.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 1.044 HD11 HD11 ' B' ' 71' ' ' ILE . 0.5 OUTLIER 41.82 31.35 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.897 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.435 ' HB2' ' CZ ' ' B' ' 68' ' ' PHE . 10.9 t80 68.31 100.96 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.62 -174.87 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.684 2.256 . . . . 0.0 112.169 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 66.5 -73.88 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.9 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 66.79 6.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.653 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.64 -46.28 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.028 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 tp 60.78 159.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.722 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.649 ' HA ' HD21 ' A' ' 81' ' ' LEU . 5.7 p-10 -136.06 19.81 3.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.168 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -35.4 63.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.833 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.859 HG12 HD13 ' B' ' 71' ' ' ILE . 3.2 mp -64.01 -46.02 95.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' A' ' 78' ' ' ASP . 0.3 OUTLIER -77.08 -27.88 54.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.895 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -27.84 62.55 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.81 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.409 ' HE3' ' HA ' ' A' ' 80' ' ' ILE . 13.5 ptp -95.64 -25.04 16.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.094 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.59 -50.45 9.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.693 ' OG ' HD21 ' B' ' 86' ' ' LEU . 13.7 p -178.93 130.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.977 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -175.89 -57.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.807 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -80.11 -28.45 38.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.789 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -72.75 -9.41 58.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.849 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.448 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 17.4 mm -89.66 -54.74 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -64.51 -21.11 66.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.197 177.799 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.752 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -86.42 -67.34 0.82 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.717 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 96' ' ' LEU . 71.6 mt -49.01 -26.61 2.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.063 0.459 . . . . 0.0 110.413 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.829 HD12 HD12 ' B' ' 93' ' ' LEU . 1.0 OUTLIER -87.87 -44.01 11.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.978 179.672 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.752 HG22 ' HA ' ' A' ' 91' ' ' ALA . 9.8 t -67.79 -8.27 34.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.583 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.71 -29.73 1.65 Allowed Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.022 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.2 OUTLIER -100.43 -1.65 35.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.864 0.364 . . . . 0.0 111.96 -179.609 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.663 ' O ' HG12 ' A' ' 98' ' ' VAL . 73.9 t80 -65.85 -57.4 8.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.625 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 97' ' ' PHE . 9.9 p 50.68 164.05 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.139 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.486 ' N ' HG22 ' A' ' 98' ' ' VAL . 5.7 mm100 -141.95 109.66 5.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.993 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -111.83 90.46 3.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.836 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.59 174.29 2.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.852 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 5.7 m -117.44 126.99 74.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.079 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 m120 60.13 -179.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -118.87 169.5 9.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.902 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -94.72 -40.45 9.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.065 -179.945 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.798 0.332 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.6 33.14 4.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.855 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' B' ' 53' ' ' HIS . . . -134.03 -117.21 0.19 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.953 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.437 ' CG ' ' O ' ' B' ' 52' ' ' ALA . 21.3 p80 43.65 29.98 0.32 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.825 0.345 . . . . 0.0 111.535 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.65 -32.6 0.69 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.425 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 1.8 m -75.66 -41.23 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.75 -41.01 63.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.922 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.577 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 2.8 t -71.92 -40.83 68.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.083 0.468 . . . . 0.0 110.888 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.762 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.5 pt-20 -62.8 -47.98 81.11 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.433 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 3.5 m -63.52 -22.61 66.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.347 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.577 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 2.7 mtt-85 -68.47 -71.65 0.21 Allowed 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.791 -179.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.0 mm? -61.27 -24.91 66.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 119.173 -1.011 . . . . 0.0 109.858 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.49 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -64.96 -37.2 86.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.713 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -31.13 69.03 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.033 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.532 ' HA ' HD21 ' B' ' 67' ' ' LEU . 0.3 OUTLIER -68.37 -27.81 66.57 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.349 178.29 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.47 ' HB2' ' HB2' ' A' ' 65' ' ' GLU . 2.2 tm-20 -80.97 -31.48 34.78 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.414 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -49.58 64.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.795 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.662 HD12 ' O ' ' B' ' 68' ' ' PHE . 3.7 pp -62.89 -27.0 69.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.939 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.662 ' O ' HD12 ' B' ' 67' ' ' LEU . 2.1 m-85 64.64 160.53 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.634 ' O ' HD23 ' B' ' 69' ' ' LEU . 10.2 tt -143.75 88.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.792 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 51.39 51.72 16.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.076 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 1.044 HD11 HD11 ' A' ' 71' ' ' ILE . 0.5 OUTLIER 41.83 31.34 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.869 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 72' ' ' PHE . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 68' ' ' PHE . 10.9 t80 68.32 100.78 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.062 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.45 -174.76 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.638 2.226 . . . . 0.0 112.236 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 66.36 -74.37 0.06 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.051 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.82 -69.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.944 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -66.86 0.24 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp 60.03 166.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.952 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' ASP . . . . . 0.637 ' HA ' HD21 ' B' ' 81' ' ' LEU . 5.6 p-10 -136.15 19.87 3.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.088 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -35.42 63.24 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.864 0.364 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.855 HG12 HD13 ' A' ' 71' ' ' ILE . 3.2 mp -64.06 -45.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.907 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.637 HD21 ' HA ' ' B' ' 78' ' ' ASP . 0.3 OUTLIER -77.26 -27.89 53.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.777 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -27.79 62.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.814 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 13.5 ptp -95.64 -25.07 16.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.023 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.57 -50.42 10.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.974 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 13.7 p -178.91 130.12 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.828 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.693 HD21 ' OG ' ' A' ' 85' ' ' SER . 0.2 OUTLIER -175.91 -57.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.827 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -80.25 -28.43 38.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.758 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.65 -9.45 58.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.843 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.443 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 17.0 mm -89.56 -54.75 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 94' ' ' THR . 0.0 OUTLIER -64.48 -21.18 66.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.191 177.787 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 91' ' ' ALA . . . . . 0.754 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -86.48 -67.22 0.83 Allowed 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.733 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.424 ' O ' ' HB2' ' B' ' 96' ' ' LEU . 71.5 mt -49.06 -26.65 2.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.13 0.491 . . . . 0.0 110.399 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.829 HD12 HD12 ' A' ' 93' ' ' LEU . 1.0 OUTLIER -87.77 -44.15 11.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.007 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.754 HG22 ' HA ' ' B' ' 91' ' ' ALA . 9.7 t -67.75 -8.2 33.62 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.549 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.72 -29.74 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.62 -0.8 . . . . 0.0 113.062 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.432 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -100.45 -1.65 35.27 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.963 0.381 . . . . 0.0 111.936 -179.663 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.678 ' O ' HG12 ' B' ' 98' ' ' VAL . 74.4 t80 -65.82 -57.38 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.681 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.678 HG12 ' O ' ' B' ' 97' ' ' PHE . 10.0 p 50.77 164.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.151 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.487 ' N ' HG22 ' B' ' 98' ' ' VAL . 5.7 mm100 -141.95 109.57 5.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.945 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -111.83 90.52 3.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.852 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.54 174.24 2.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.913 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.9 m -117.34 127.01 74.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.197 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 m120 60.2 -179.18 0.1 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.905 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -119.04 169.48 9.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.929 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -94.55 -40.54 9.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.268 -0.872 . . . . 0.0 111.097 -179.912 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.783 0.325 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.37 -170.13 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.948 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.21 63.47 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.132 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.7 p-80 -134.24 147.25 50.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.828 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.619 HD23 HG22 ' B' ' 57' ' ' VAL . 0.5 OUTLIER -136.31 -53.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.575 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.1 m 21.5 -86.31 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -68.31 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.974 0.416 . . . . 0.0 111.324 -179.251 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.615 ' HA ' ' HB2' ' A' ' 60' ' ' ARG . 22.6 t -53.82 -27.97 16.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.726 -179.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.718 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -66.55 -46.8 74.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.189 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.406 ' N ' ' HG2' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -68.02 -17.33 64.38 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.381 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.615 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -73.72 0.17 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.663 -179.805 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.826 HD13 HD22 ' A' ' 64' ' ' LEU . 4.1 mm? -62.35 -32.35 73.12 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.69 -179.364 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.687 ' HB2' HD12 ' B' ' 61' ' ' LEU . 3.4 tt0 -61.29 -36.31 79.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.199 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -81.09 -16.1 54.09 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.989 0.423 . . . . 0.0 110.023 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.983 HD23 ' HG2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -79.12 -27.19 42.83 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.376 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.983 ' HG2' HD23 ' A' ' 64' ' ' LEU . 7.6 mm-40 -102.86 -21.6 13.99 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.125 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.61 -36.07 83.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.962 0.411 . . . . 0.0 110.171 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 69' ' ' LEU . 0.2 OUTLIER -83.27 -0.35 49.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.742 179.384 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 73.1 m-85 67.4 -96.65 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.067 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 67' ' ' LEU . 0.4 OUTLIER 47.21 28.0 0.92 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.696 0.284 . . . . 0.0 111.155 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.8 mt -154.7 -45.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.161 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.824 HD13 ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.43 46.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.093 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.48 ' CG ' ' O ' ' A' ' 72' ' ' PHE . 10.6 p90 -123.28 74.42 50.76 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.939 0.4 . . . . 0.0 110.866 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.54 16.62 1.88 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.818 2.345 . . . . 0.0 112.867 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.626 HH11 HD21 ' A' ' 77' ' ' LEU . 0.3 OUTLIER -86.64 -58.32 2.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.839 0.352 . . . . 0.0 111.028 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 59.0 27.79 16.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -153.67 -53.09 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.793 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.626 HD21 HH11 ' A' ' 74' ' ' ARG . 4.6 pp -120.39 -173.45 2.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.808 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.755 ' CG ' HD23 ' A' ' 81' ' ' LEU . 3.0 m-20 -137.49 93.96 2.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.763 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.5 -38.88 88.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.881 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.063 HG22 HD11 ' B' ' 81' ' ' LEU . 42.5 mm -73.51 -43.26 55.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 1.077 HD11 HG22 ' B' ' 80' ' ' ILE . 1.7 mm? -74.18 -22.29 59.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.252 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.912 ' HA ' HD22 ' A' ' 86' ' ' LEU . 2.6 mttt -90.35 -27.71 19.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.872 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.84 -23.91 25.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.062 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.589 ' HB2' HD12 ' B' ' 81' ' ' LEU . 12.8 m-20 -103.92 104.15 14.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.04 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.477 ' HB3' HD21 ' B' ' 86' ' ' LEU . 58.3 m 60.85 113.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.972 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.912 HD22 ' HA ' ' A' ' 82' ' ' LYS . 6.4 tp -178.45 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.027 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.69 -25.04 17.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.046 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.757 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.0 OUTLIER -70.24 -10.16 58.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.301 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.549 HG21 ' HB ' ' B' ' 89' ' ' ILE . 17.1 mm -90.73 -56.79 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.593 ' O ' ' HB ' ' A' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.22 64.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.22 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.696 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -86.96 -56.11 3.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.252 179.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.757 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.1 mm? -51.74 -26.27 9.14 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.891 HD13 ' HB3' ' B' ' 93' ' ' LEU . 0.3 OUTLIER -90.46 -38.51 13.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.696 HG22 ' HA ' ' A' ' 91' ' ' ALA . 2.1 t -67.33 -11.22 57.07 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.1 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.25 -28.6 1.62 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.486 -0.864 . . . . 0.0 113.052 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.448 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -102.93 2.4 35.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.543 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 97' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 29.3 p90 -41.05 137.64 1.24 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.556 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.2 p -83.62 145.44 8.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.096 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -145.37 99.02 3.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.955 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -147.51 -46.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.908 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -107.96 128.71 54.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 35.5 m -119.29 -39.29 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.199 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -106.86 37.49 2.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -158.24 163.05 37.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.95 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -106.37 133.45 51.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.873 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.107 179.963 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 120.808 0.337 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.82 177.24 7.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.844 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.58 63.6 1.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.265 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -134.39 147.11 50.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.602 HD23 HG22 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -136.28 -52.83 0.73 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.671 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 97.3 m 21.28 -86.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 179.529 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.29 -68.24 0.3 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.889 0.376 . . . . 0.0 111.312 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.622 ' HA ' ' HB2' ' B' ' 60' ' ' ARG . 23.1 t -53.86 -28.01 16.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.687 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.7 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -66.42 -46.84 75.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.135 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.408 ' N ' ' HG2' ' B' ' 58' ' ' GLU . 0.3 OUTLIER -67.92 -17.42 64.45 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.394 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.622 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -73.75 0.17 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.737 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.832 ' CD1' HD22 ' B' ' 64' ' ' LEU . 4.1 mm? -62.17 -32.36 72.97 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.49 -0.884 . . . . 0.0 109.851 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.67 ' HB2' HD12 ' A' ' 61' ' ' LEU . 3.5 tt0 -61.39 -36.23 79.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.249 177.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -81.08 -16.12 54.05 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.047 0.451 . . . . 0.0 110.014 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 1.053 HD23 ' HG2' ' B' ' 65' ' ' GLU . 0.0 OUTLIER -79.17 -27.12 42.64 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.336 179.941 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 1.053 ' HG2' HD23 ' B' ' 64' ' ' LEU . 7.6 mm-40 -102.84 -21.66 13.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.109 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.63 -36.16 83.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.944 0.402 . . . . 0.0 110.065 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -83.04 -0.45 49.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.799 179.307 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' B' ' 67' ' ' LEU . 72.9 m-85 67.41 -96.42 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.107 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.589 ' O ' HD23 ' B' ' 69' ' ' LEU . 1.6 tt 47.06 27.98 0.84 Allowed 'General case' 0 CA--C 1.528 0.103 0 CA-C-O 120.71 0.291 . . . . 0.0 111.272 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 98.1 mt -154.81 -45.8 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.152 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.846 HD13 ' O ' ' B' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.083 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 72' ' ' PHE . . . . . 0.473 ' O ' ' CG ' ' B' ' 72' ' ' PHE . 10.6 p90 -123.25 74.46 50.56 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-O 120.963 0.411 . . . . 0.0 110.851 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -87.53 16.54 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.905 2.403 . . . . 0.0 112.898 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.68 -58.15 2.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.841 0.353 . . . . 0.0 110.941 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.07 29.91 19.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 -158.4 -50.61 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.776 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -120.15 -177.82 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.822 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 78' ' ' ASP . . . . . 0.741 ' CG ' HD23 ' B' ' 81' ' ' LEU . 3.0 m-20 -135.61 93.28 2.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.631 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.37 -38.86 88.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.928 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 1.077 HG22 HD11 ' A' ' 81' ' ' LEU . 42.5 mm -73.56 -43.2 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 1.063 HD11 HG22 ' A' ' 80' ' ' ILE . 1.7 mm? -74.17 -22.29 59.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.264 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -90.37 -27.68 19.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.867 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.98 25.08 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.998 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 84' ' ' ASP . . . . . 0.577 ' HB2' HD12 ' A' ' 81' ' ' LEU . 12.7 m-20 -103.86 104.26 14.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.959 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 85' ' ' SER . . . . . 0.556 ' HB3' HD11 ' A' ' 86' ' ' LEU . 58.4 m 60.71 112.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.866 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.477 HD21 ' HB3' ' A' ' 85' ' ' SER . 0.1 OUTLIER -177.45 -39.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.952 -179.945 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.23 -24.93 17.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.134 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.758 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.0 OUTLIER -70.19 -10.15 57.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.391 179.875 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.549 ' HB ' HG21 ' A' ' 89' ' ' ILE . 17.1 mm -90.8 -56.73 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.59 ' O ' ' HB ' ' B' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.19 64.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.263 177.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 91' ' ' ALA . . . . . 0.722 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.05 -56.09 3.53 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.201 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.758 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.1 mm? -51.72 -26.15 8.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.789 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.891 ' HB3' HD13 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -90.6 -38.58 13.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.676 179.408 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.722 HG22 ' HA ' ' B' ' 91' ' ' ALA . 2.1 t -67.2 -11.34 57.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.075 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.31 -28.44 1.64 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.552 -0.833 . . . . 0.0 113.053 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.446 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.4 OUTLIER -103.0 2.37 34.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.546 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 97' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 29.2 p90 -41.14 137.77 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.561 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.3 p -83.71 145.43 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -145.41 99.02 3.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.922 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -147.39 -47.02 0.17 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -107.83 128.68 54.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 35.5 m -119.26 -39.39 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.222 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -106.74 37.62 2.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.864 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.55 162.9 37.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.913 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -106.28 133.41 51.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.896 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.163 179.99 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.865 0.365 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.88 -177.13 3.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.814 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 66.13 131.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.86 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' B' ' 53' ' ' HIS . 2.5 m-70 -92.52 127.4 38.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.165 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.702 HD12 HG13 ' B' ' 57' ' ' VAL . 6.3 tp -174.11 -90.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.003 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.57 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.6 m 3.02 -100.29 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.557 ' N ' HG22 ' A' ' 55' ' ' THR . 4.8 tp10 -35.97 -69.92 0.1 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.717 HG13 HD12 ' B' ' 54' ' ' LEU . 5.1 t -46.66 -29.93 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.553 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.63 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.4 pt-20 -66.88 -48.25 69.33 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 2.1 m -65.86 -14.63 61.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.201 177.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.431 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -77.03 -75.95 0.19 Allowed 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.835 -179.725 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 1.05 HD13 HD21 ' A' ' 64' ' ' LEU . 3.9 mm? -60.36 -25.3 65.75 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.803 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.556 ' HB2' HD12 ' B' ' 61' ' ' LEU . 11.4 tt0 -73.13 -37.08 66.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.0 mmt180 -58.82 -39.99 82.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.488 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 1.05 HD21 HD13 ' A' ' 61' ' ' LEU . 1.2 pp -78.46 -23.28 46.6 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.238 178.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.51 ' HB3' ' HA ' ' A' ' 62' ' ' GLU . 1.2 tp10 -65.68 -34.56 78.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.475 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -28.18 62.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.422 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.454 ' C ' ' CG ' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -92.68 -0.36 57.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.256 179.849 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.454 ' CG ' ' C ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER 47.13 -88.81 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.592 179.917 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 67' ' ' LEU . 3.6 tp 64.26 24.69 13.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.684 0.278 . . . . 0.0 110.894 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.5 mt -148.79 -48.55 0.15 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.551 ' H ' HD12 ' A' ' 71' ' ' ILE . 3.8 mp -82.82 -34.22 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.185 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.83 92.52 4.4 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.98 -170.37 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.471 2.114 . . . . 0.0 112.34 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -145.82 85.07 1.68 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.251 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.13 164.49 14.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.585 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.56 49.61 1.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.732 HD13 ' H ' ' A' ' 78' ' ' ASP . 0.2 OUTLIER -179.73 148.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.009 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.732 ' H ' HD13 ' A' ' 77' ' ' LEU . 1.2 p30 -86.97 79.8 8.63 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -50.65 -28.01 8.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.25 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.815 HG22 HD21 ' B' ' 81' ' ' LEU . 21.0 mt -76.7 -60.3 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.953 0.406 . . . . 0.0 110.732 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 1.07 HD22 HD22 ' B' ' 81' ' ' LEU . 2.3 mm? -54.68 -19.56 6.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.764 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.55 -25.11 13.33 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.1 mmm -98.94 -2.01 38.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.51 87.98 2.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.389 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.06 -156.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.733 HD12 ' HB3' ' B' ' 86' ' ' LEU . 4.3 mm? 63.26 29.63 15.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.835 0.35 . . . . 0.0 110.936 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.15 -42.33 1.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.608 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 17.4 t70 -70.71 -9.54 57.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.051 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.676 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.6 mp -88.66 -56.09 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.594 ' HG3' HG21 ' B' ' 89' ' ' ILE . 0.1 OUTLIER -63.41 -19.97 65.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.259 177.869 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.9 -63.74 1.27 Allowed 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.65 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.547 HD23 ' HB2' ' A' ' 96' ' ' LEU . 1.2 tt -51.54 -24.41 5.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.947 0.403 . . . . 0.0 110.431 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.499 ' HB3' HD12 ' B' ' 93' ' ' LEU . 3.8 mm? -90.12 -40.99 11.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.485 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.79 -13.63 59.81 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.167 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.28 -50.23 0.31 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.228 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.612 HD22 ' N ' ' A' ' 96' ' ' LEU . 2.6 mm? -98.12 -2.48 39.91 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.24 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.92 32.96 0.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.834 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.566 HG11 ' HB2' ' A' ' 101' ' ' ASN . 18.3 t -76.59 130.84 35.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.931 0.396 . . . . 0.0 111.266 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.6 mm100 -65.7 -62.63 1.4 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.071 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -137.78 -44.82 0.53 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.128 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.566 ' HB2' HG11 ' A' ' 98' ' ' VAL . 2.1 t30 69.54 107.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.904 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.561 HG13 ' O ' ' A' ' 102' ' ' VAL . 11.0 p -129.41 113.1 26.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.048 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -143.11 -53.9 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.951 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.5 ptpp? -173.71 -43.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.898 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -94.55 153.77 17.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.921 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.051 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.778 0.323 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.43 ' O ' ' HB3' ' B' ' 52' ' ' ALA . 0.0 OUTLIER -148.18 -165.07 2.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.861 179.967 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 52' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' B' ' 51' ' ' ARG . . . 69.05 131.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.851 0.358 . . . . 0.0 111.102 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 53' ' ' HIS . 2.5 m-70 -92.74 127.43 38.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.075 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.717 HD12 HG13 ' A' ' 57' ' ' VAL . 6.3 tp -174.08 -90.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.031 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.578 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 98.8 m 3.17 -100.37 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.559 ' N ' HG22 ' B' ' 55' ' ' THR . 4.8 tp10 -35.7 -70.15 0.09 Allowed 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 57' ' ' VAL . . . . . 0.702 HG13 HD12 ' A' ' 54' ' ' LEU . 5.3 t -46.68 -30.06 1.26 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.571 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.404 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.636 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.4 pt-20 -66.71 -48.34 69.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 2.1 m -65.73 -14.62 61.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.288 177.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.425 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -77.02 -75.97 0.19 Allowed 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.798 -179.603 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 1.039 HD13 HD21 ' B' ' 64' ' ' LEU . 3.9 mm? -60.39 -25.31 65.81 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 119.74 -0.784 . . . . 0.0 109.793 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.575 ' HB2' HD12 ' A' ' 61' ' ' LEU . 11.3 tt0 -73.05 -37.18 66.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' B' ' 59' ' ' SER . 1.9 mmt180 -58.89 -39.9 82.8 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.542 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 1.039 HD21 HD13 ' B' ' 61' ' ' LEU . 1.2 pp -78.44 -23.33 46.66 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.272 178.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' GLU . . . . . 0.493 ' HB3' ' HA ' ' B' ' 62' ' ' GLU . 1.1 tp10 -65.64 -34.58 78.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.479 178.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.57 -28.18 62.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.402 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.444 ' C ' ' CG ' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -92.65 -0.23 57.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.266 179.803 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 68' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 46.96 -88.79 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.504 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.442 ' N ' ' O ' ' B' ' 67' ' ' LEU . 0.2 OUTLIER 64.19 24.81 13.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.694 0.283 . . . . 0.0 110.943 -179.849 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 mt -148.86 -48.65 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.91 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' ILE . . . . . 0.547 ' H ' HD12 ' B' ' 71' ' ' ILE . 3.8 mp -82.86 -34.0 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.26 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.95 92.47 4.46 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -68.9 -170.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.46 2.107 . . . . 0.0 112.411 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -146.76 81.04 1.55 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.543 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' B' ' 77' ' ' LEU . 3.6 mt-10 -119.96 12.79 12.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.638 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 66.12 -73.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.752 0.311 . . . . 0.0 110.889 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' B' ' 75' ' ' GLU . 0.5 OUTLIER -49.48 149.4 2.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.902 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 78' ' ' ASP . . . . . 0.508 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 1.4 p30 -93.42 79.52 4.39 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.096 0.474 . . . . 0.0 111.464 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -51.33 -27.79 10.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.062 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.799 HG22 ' CD2' ' A' ' 81' ' ' LEU . 20.9 mt -76.69 -60.24 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.95 0.405 . . . . 0.0 110.755 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 1.07 HD22 HD22 ' A' ' 81' ' ' LEU . 2.3 mm? -54.75 -19.59 6.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.701 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.41 -25.22 13.35 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 8.2 mmm -98.87 -2.04 38.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -178.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.42 88.02 2.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.03 -156.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.053 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.832 HD22 ' CD1' ' A' ' 81' ' ' LEU . 5.9 mp 63.28 29.54 15.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.904 0.383 . . . . 0.0 110.972 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.25 -42.48 1.51 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.732 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 17.4 t70 -70.65 -9.46 57.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.052 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.668 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.6 mp -88.67 -55.98 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 90' ' ' GLU . . . . . 0.59 ' HG3' HG21 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -63.35 -20.04 65.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.338 177.752 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.93 -63.72 1.27 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.614 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 92' ' ' LEU . . . . . 0.541 HD23 ' HB2' ' B' ' 96' ' ' LEU . 1.2 tt -51.52 -24.38 5.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.918 0.389 . . . . 0.0 110.433 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.499 HD12 ' HB3' ' A' ' 93' ' ' LEU . 3.9 mm? -90.21 -40.96 11.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.403 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.84 -13.53 59.71 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.223 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.32 -50.2 0.31 Allowed Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.457 -0.878 . . . . 0.0 113.182 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.602 HD22 ' N ' ' B' ' 96' ' ' LEU . 2.6 mm? -98.18 -2.62 39.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.95 33.1 0.13 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.788 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 98' ' ' VAL . . . . . 0.551 HG11 ' HB2' ' B' ' 101' ' ' ASN . 18.6 t -76.69 130.87 35.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.227 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 8.6 mm100 -65.72 -62.71 1.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.956 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -137.84 -44.81 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 101' ' ' ASN . . . . . 0.551 ' HB2' HG11 ' B' ' 98' ' ' VAL . 2.1 t30 69.55 107.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.829 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.562 ' O ' HG13 ' B' ' 102' ' ' VAL . 11.0 p -129.33 113.0 26.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.106 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -143.11 -53.83 0.39 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.8 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -173.75 -44.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -94.4 153.76 17.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.865 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.173 -0.918 . . . . 0.0 111.194 179.92 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.931 0.396 . . . . 0.0 111.313 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.75 -31.29 6.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.817 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.64 HD23 HG13 ' B' ' 57' ' ' VAL . 9.0 mt 64.47 -80.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.239 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.502 ' C ' ' O ' ' A' ' 54' ' ' LEU . 97.2 m 6.54 -90.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.46 -70.05 0.12 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.639 HG13 HD23 ' B' ' 54' ' ' LEU . 4.6 t -50.18 -25.08 2.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.577 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.742 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.39 73.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.62 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.574 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 20.0 m -69.49 -15.72 63.31 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -73.38 -74.03 0.19 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.475 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.4 mm? -62.06 -28.29 69.49 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 119.362 -0.935 . . . . 0.0 109.992 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.536 ' HB2' HD12 ' B' ' 61' ' ' LEU . 2.6 tt0 -65.08 -39.04 92.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.2 ttm105 -66.73 -28.18 68.21 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.849 HD11 ' CD2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -72.77 -27.42 61.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.748 178.533 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.783 ' O ' HD11 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -78.01 -32.96 51.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.015 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.75 -22.93 45.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.6 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.826 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.9 tm? -77.56 -29.52 52.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.884 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.856 ' CD1' HD12 ' A' ' 71' ' ' ILE . 0.1 OUTLIER 72.34 -165.57 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.778 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.466 ' CB ' ' O ' ' A' ' 68' ' ' PHE . 8.0 tp 86.88 -33.05 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.85 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.849 ' CD2' HD11 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -113.68 -16.39 12.33 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.474 0.178 . . . . 0.0 111.225 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.856 HD12 ' CD1' ' A' ' 68' ' ' PHE . 60.8 mt -51.64 -37.18 19.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.714 0.293 . . . . 0.0 111.271 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.438 ' CG ' ' HD2' ' A' ' 73' ' ' PRO . 1.4 t80 -109.03 142.24 25.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.815 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.438 ' HD2' ' CG ' ' A' ' 72' ' ' PHE . 51.2 Cg_endo -69.15 -28.8 27.74 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.458 2.106 . . . . 0.0 112.291 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -112.13 -179.48 3.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.739 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -98.06 -49.29 4.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.056 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.07 146.47 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.023 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.688 HD12 HG13 ' A' ' 80' ' ' ILE . 0.8 OUTLIER -103.13 -80.05 0.52 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.738 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 71.85 -57.58 0.61 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.298 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.39 6.16 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.684 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.688 HG13 HD12 ' A' ' 77' ' ' LEU . 58.0 mt -61.16 -29.97 46.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 111.144 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.787 ' O ' HD12 ' A' ' 86' ' ' LEU . 1.4 mt -73.2 -26.7 61.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.049 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.8 -19.63 22.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.5 mtm -93.01 -22.88 18.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.039 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -86.8 -60.72 1.91 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.65 120.41 0.91 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.882 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.787 HD12 ' O ' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -169.76 -41.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.018 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -74.08 -38.74 63.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.029 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.782 ' O ' HD23 ' A' ' 92' ' ' LEU . 5.1 m-20 -70.36 -11.41 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.698 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.1 mp -91.55 -54.95 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.24 -19.63 64.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.33 4.26 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.158 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.782 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.3 mm? -53.08 -26.18 15.33 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.081 0.467 . . . . 0.0 109.841 178.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.441 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 0.5 OUTLIER -92.55 -38.05 12.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.165 179.206 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.5 m -63.3 -15.05 56.08 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.012 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.7 -28.85 1.11 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.41 -0.9 . . . . 0.0 113.395 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.31 5.41 34.54 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 21.9 p90 -36.69 139.56 0.18 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.688 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 28.0 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.082 179.973 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.828 0.347 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.64 -31.29 6.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.858 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.639 HD23 HG13 ' A' ' 57' ' ' VAL . 9.0 mt 64.32 -80.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.215 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.499 ' C ' ' O ' ' B' ' 54' ' ' LEU . 97.6 m 6.39 -90.47 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -70.17 0.11 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.948 0.404 . . . . 0.0 112.083 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.64 HG13 HD23 ' A' ' 54' ' ' LEU . 4.6 t -50.15 -25.0 2.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.562 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.732 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.43 73.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.612 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.578 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 19.9 m -69.45 -15.68 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.472 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.3 OUTLIER -73.46 -74.0 0.19 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.505 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.742 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.4 mm? -62.02 -28.34 69.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.841 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.53 ' HB2' HD12 ' A' ' 61' ' ' LEU . 2.6 tt0 -65.15 -38.97 92.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.1 ttm105 -66.82 -28.03 68.03 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.847 HD11 ' CD2' ' B' ' 70' ' ' LEU . 0.1 OUTLIER -72.96 -27.49 61.85 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.567 178.644 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.785 ' O ' HD11 ' B' ' 71' ' ' ILE . 0.1 OUTLIER -77.96 -33.02 51.73 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.027 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.67 -23.01 45.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.596 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.838 HD13 ' O ' ' B' ' 67' ' ' LEU . 2.9 tm? -77.47 -29.48 52.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.987 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.858 ' CD1' HD12 ' B' ' 71' ' ' ILE . 0.1 OUTLIER 72.24 -165.46 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.826 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' B' ' 68' ' ' PHE . 0.3 OUTLIER 86.58 -33.01 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.891 179.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.847 ' CD2' HD11 ' B' ' 64' ' ' LEU . 0.1 OUTLIER -113.49 -16.37 12.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.525 0.203 . . . . 0.0 111.254 -179.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.858 HD12 ' CD1' ' B' ' 68' ' ' PHE . 60.9 mt -51.66 -37.1 19.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.767 0.318 . . . . 0.0 111.354 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . 0.441 ' CG ' ' HD2' ' B' ' 73' ' ' PRO . 1.4 t80 -109.04 142.1 24.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.774 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' B' ' 72' ' ' PHE . 51.3 Cg_endo -69.14 -28.75 27.84 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.447 2.098 . . . . 0.0 112.361 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -111.84 179.77 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.875 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -93.45 -60.33 1.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.988 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.49 155.72 26.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.856 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.765 HD22 HD12 ' B' ' 80' ' ' ILE . 1.9 mt -109.21 -79.04 0.59 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.785 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 72.85 -57.87 0.62 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.399 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.44 6.12 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.768 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.765 HD12 HD22 ' B' ' 77' ' ' LEU . 58.1 mt -61.1 -30.08 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.057 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 81' ' ' LEU . 1.4 mt -73.11 -26.82 61.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.065 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.68 -19.65 22.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.212 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 9.6 mtm -93.05 -22.84 18.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 0.0 111.053 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . 0.405 ' HB3' ' CD1' ' A' ' 81' ' ' LEU . 1.7 m-20 -86.79 -60.76 1.9 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.901 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.68 120.53 0.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.98 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.545 ' CA ' HD13 ' B' ' 89' ' ' ILE . 0.5 OUTLIER -169.78 -42.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -73.71 -38.72 64.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.982 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.803 ' O ' HD23 ' B' ' 92' ' ' LEU . 5.1 m-20 -70.38 -11.47 60.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.34 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.711 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.1 mp -91.52 -55.09 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.21 -19.55 64.62 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.136 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.28 4.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.255 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.803 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.3 mm? -53.12 -26.1 15.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.047 0.451 . . . . 0.0 109.833 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -92.56 -38.12 12.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.087 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -63.21 -15.23 56.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.98 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.55 -28.96 1.12 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.412 -0.899 . . . . 0.0 113.37 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.534 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.5 OUTLIER -104.23 5.33 34.7 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.327 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.445 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 21.5 p90 -36.73 139.51 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.68 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 27.2 t . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.103 179.965 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.639 ' HB1' ' CE1' ' B' ' 53' ' ' HIS . . . . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.683 0.278 . . . . 0.0 111.049 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.644 ' CE1' ' HB1' ' B' ' 52' ' ' ALA . 90.0 m-70 65.23 153.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.438 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.624 HD12 ' N ' ' A' ' 54' ' ' LEU . 4.6 mp 64.26 -137.52 0.29 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.705 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.435 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.7 m 27.94 -84.94 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 54' ' ' LEU . 4.1 mm-40 -66.41 -64.43 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.138 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.623 ' HB ' HG11 ' B' ' 57' ' ' VAL . 20.6 t -56.84 -44.11 81.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.193 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.699 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 4.7 pt-20 -55.4 -48.68 73.99 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-O 121.451 0.643 . . . . 0.0 109.514 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.436 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 1.2 m -64.38 -19.06 65.25 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.654 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.04 -73.85 0.19 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.228 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.694 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.5 mm? -62.97 -25.36 68.33 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.09 -179.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.561 ' HB2' HD12 ' B' ' 61' ' ' LEU . 2.5 tt0 -69.33 -38.3 78.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.1 OUTLIER -65.38 -30.36 71.17 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 177.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.451 178.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.403 ' HA ' ' HG3' ' B' ' 65' ' ' GLU . 0.0 OUTLIER -73.53 -32.15 64.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.163 178.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.96 -23.12 44.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.843 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.99 -22.84 33.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 63.76 175.65 0.17 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.967 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tp -129.71 -66.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.973 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.5 mt -124.6 47.25 2.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.18 -58.05 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.086 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -113.73 101.72 54.08 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.82 -51.2 1.36 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.391 2.06 . . . . 0.0 112.348 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.57 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.804 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -175.99 118.22 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.002 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -159.08 -63.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 74.59 5.66 4.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -130.94 -34.04 1.51 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.659 0.266 . . . . 0.0 111.354 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -28.02 61.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.333 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.67 -65.03 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.005 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.457 ' H ' HD23 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -62.67 -18.75 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.07 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -80.72 -31.83 35.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 mtm -89.1 -18.2 27.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.98 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -94.25 -40.29 10.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.91 0.386 . . . . 0.0 110.847 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.03 139.07 30.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.45 18.16 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.112 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.78 23.25 11.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.128 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.491 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.9 OUTLIER -73.83 -11.29 60.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.896 0.379 . . . . 0.0 110.936 179.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.711 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.4 mp -93.31 -50.93 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.83 -21.58 66.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.459 -0.791 . . . . 0.0 108.931 177.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.02 -48.97 7.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.195 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.491 HD12 ' O ' ' A' ' 88' ' ' ASP . 12.7 mt -56.86 -25.27 56.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.202 0.525 . . . . 0.0 109.778 178.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.12 -36.68 11.96 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.225 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.0 m -65.82 -15.41 62.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.933 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.37 -36.36 0.65 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.218 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.452 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -97.94 -2.28 40.93 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.4 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 18.2 p90 38.78 75.84 0.07 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.806 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 42.1 t . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.935 -179.974 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . 0.644 ' HB1' ' CE1' ' A' ' 53' ' ' HIS . . . . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.713 0.292 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.639 ' CE1' ' HB1' ' A' ' 52' ' ' ALA . 89.8 m-70 65.38 153.66 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.027 0.442 . . . . 0.0 111.238 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.622 ' N ' HD12 ' B' ' 54' ' ' LEU . 4.5 mp 64.13 -137.5 0.3 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.768 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.4 m 27.88 -84.83 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' B' ' 54' ' ' LEU . 4.1 mm-40 -66.45 -64.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.794 0.331 . . . . 0.0 111.192 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.623 HG11 ' HB ' ' A' ' 57' ' ' VAL . 20.6 t -56.86 -44.12 81.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.119 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.694 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 4.7 pt-20 -55.54 -48.49 74.64 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.336 0.589 . . . . 0.0 109.477 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 1.2 m -64.5 -19.06 65.36 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.24 -73.66 0.2 Allowed 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.203 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.5 mm? -63.14 -25.16 68.22 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.126 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.531 ' HB2' HD12 ' A' ' 61' ' ' LEU . 2.4 tt0 -69.52 -38.2 77.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 176.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -30.42 71.22 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.395 178.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.403 ' HG3' ' HA ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -73.5 -32.21 64.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.129 179.037 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -23.2 44.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.834 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -22.86 33.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.145 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 63.81 175.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.911 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 mp -129.59 -67.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 42.7 mt -124.01 47.36 2.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.104 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.27 -58.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . 0.405 ' HA ' ' HD2' ' B' ' 73' ' ' PRO . 7.5 m-85 -113.66 101.79 54.12 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' B' ' 72' ' ' PHE . 36.7 Cg_endo -65.85 -51.19 1.35 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.325 2.017 . . . . 0.0 112.462 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.66 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.114 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -152.1 -174.64 4.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.924 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 68.93 114.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.069 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.0 mp -101.64 47.62 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.645 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -127.25 -34.03 2.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.18 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -28.06 62.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.195 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.61 -65.05 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.988 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.467 ' H ' HD23 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -62.65 -18.8 63.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.04 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -80.7 -31.88 36.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 0.0 110.742 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 1.2 mtm -88.98 -18.34 27.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.93 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -94.28 -40.18 10.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.774 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.12 139.03 30.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.882 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.6 tp -94.51 18.16 11.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.91 23.2 11.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.128 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.473 ' O ' HD12 ' B' ' 92' ' ' LEU . 0.9 OUTLIER -73.92 -11.25 60.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 0.0 110.893 179.52 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.701 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.4 mp -93.11 -51.06 11.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.02 -21.34 66.83 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.809 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.07 -49.03 7.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.211 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.473 HD12 ' O ' ' B' ' 88' ' ' ASP . 12.7 mt -56.85 -25.27 56.03 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.104 0.478 . . . . 0.0 109.726 178.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.05 -36.76 11.97 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.154 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.9 m -65.87 -15.45 62.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.814 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.33 -36.46 0.65 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.27 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.445 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.4 OUTLIER -97.96 -2.33 40.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.997 0.399 . . . . 0.0 112.049 -179.363 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.403 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 18.0 p90 38.8 75.79 0.07 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.749 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.043 179.952 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.108 0 CA-C-O 120.922 0.392 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 51.63 -97.74 0.06 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.929 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.626 ' HG ' HG13 ' B' ' 57' ' ' VAL . 0.4 OUTLIER 66.14 -73.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.601 0.238 . . . . 0.0 111.335 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.449 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 55.7 m 9.34 -76.54 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.6 pt-20 -63.27 -60.56 3.24 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.67 ' HB ' HG11 ' B' ' 57' ' ' VAL . 17.2 t -59.12 -48.58 86.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.651 -179.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.724 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.02 -46.41 68.4 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 121.292 0.568 . . . . 0.0 109.555 179.035 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.7 -21.42 66.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.544 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.45 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.3 -71.59 0.25 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.381 -179.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -62.1 -30.68 71.18 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.812 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.453 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 45.7 tt0 -63.29 -37.56 87.73 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.89 -29.93 69.15 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.8 -27.78 64.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 121.484 0.659 . . . . 0.0 109.516 178.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -78.56 -31.77 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.502 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.67 -33.43 66.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.764 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 3.9 mp -63.08 -26.05 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.471 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 3.2 m-85 68.71 -61.0 0.43 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.442 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 70.71 -65.38 0.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.768 0.318 . . . . 0.0 110.667 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 30.9 mt -137.41 53.9 1.85 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.606 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.895 HG23 HG23 ' B' ' 71' ' ' ILE . 36.1 mm -127.14 -45.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.187 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.431 ' O ' ' CD2' ' A' ' 72' ' ' PHE . 37.6 p90 -48.0 105.5 0.5 Allowed Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.213 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -79.15 132.65 10.49 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.136 . . . . 0.0 112.289 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.0 -46.86 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.61 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -165.67 65.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.043 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.56 -81.16 0.36 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.7 mt -96.93 112.09 24.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.647 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.491 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 4.0 t0 -178.94 89.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.98 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.49 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 13.6 ptt? -53.09 -45.26 68.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.684 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.896 HG13 HD11 ' B' ' 81' ' ' LEU . 45.1 mm -65.07 -49.57 78.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.775 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.925 HD11 HG13 ' B' ' 80' ' ' ILE . 1.2 mm? -64.84 -21.29 66.76 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 9.0 pttp -93.54 -24.71 17.87 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . 0.5 ' HE3' HD13 ' A' ' 80' ' ' ILE . 18.5 ptp -93.91 -15.26 25.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.82 -65.37 0.31 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.75 0.309 . . . . 0.0 110.935 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.621 ' O ' HD12 ' A' ' 86' ' ' LEU . 42.9 m 65.04 65.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.651 HD23 HG13 ' B' ' 89' ' ' ILE . 1.5 mp -150.15 32.67 0.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.703 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -112.99 -35.91 5.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.994 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.635 ' O ' HD13 ' A' ' 92' ' ' LEU . 2.3 m-20 -71.75 -13.47 61.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 111.031 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.786 HG13 HD23 ' B' ' 86' ' ' LEU . 26.2 mm -86.16 -57.37 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.551 ' O ' ' HB ' ' A' ' 94' ' ' THR . 30.2 tt0 -64.13 -18.84 64.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.303 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.703 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -83.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.525 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.635 HD13 ' O ' ' A' ' 88' ' ' ASP . 6.5 mp -49.31 -29.22 5.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.024 0.44 . . . . 0.0 110.448 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.476 ' HG ' ' HA ' ' B' ' 90' ' ' GLU . 4.3 mm? -85.24 -38.97 18.31 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.5 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.703 HG22 ' HA ' ' A' ' 91' ' ' ALA . 8.7 t -73.16 -7.59 52.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.957 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -113.05 -32.53 2.19 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 96' ' ' LEU . 2.8 mm? -98.31 -7.42 29.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.975 0.388 . . . . 0.0 111.843 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 44.8 p90 31.92 42.03 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.887 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.4 p . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.284 -179.682 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.854 0.359 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.4 ' O ' ' N ' ' B' ' 55' ' ' THR . 5.5 t-80 51.79 -97.75 0.06 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.896 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.606 ' HG ' HG13 ' A' ' 57' ' ' VAL . 0.4 OUTLIER 66.18 -73.94 0.07 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.664 0.268 . . . . 0.0 111.317 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.458 ' O ' ' HG3' ' B' ' 58' ' ' GLU . 57.3 m 9.45 -76.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.6 pt-20 -63.31 -60.47 3.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.67 HG11 ' HB ' ' A' ' 57' ' ' VAL . 17.1 t -59.05 -48.63 86.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 122.157 -0.339 . . . . 0.0 111.665 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.741 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.08 -46.37 68.58 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.345 0.593 . . . . 0.0 109.583 179.11 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.66 -21.52 66.75 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.536 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.432 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.15 -71.83 0.24 Allowed 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.285 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -62.04 -30.77 71.2 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 119.467 -0.893 . . . . 0.0 109.798 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.455 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 45.6 tt0 -63.14 -37.53 87.6 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.79 -29.97 69.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.258 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -27.81 64.14 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.498 178.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -78.59 -31.75 47.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.553 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.65 -33.34 66.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.861 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.47 ' O ' ' HB2' ' B' ' 68' ' ' PHE . 3.9 mp -63.11 -26.2 68.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.378 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' B' ' 69' ' ' LEU . 3.2 m-85 68.77 -60.52 0.44 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.631 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' B' ' 68' ' ' PHE . 2.0 mt 69.51 -64.58 0.34 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.818 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' B' ' 70' ' ' LEU . 30.7 mt -137.57 53.86 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.973 0.416 . . . . 0.0 110.666 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.895 HG23 HG23 ' A' ' 71' ' ' ILE . 36.8 mm -127.21 -44.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.173 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . 0.43 ' CD2' ' O ' ' B' ' 72' ' ' PHE . 37.7 p90 -47.96 105.42 0.49 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.212 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -79.11 132.69 10.56 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.532 2.154 . . . . 0.0 112.24 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.2 -50.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.12 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.34 31.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.88 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -141.79 136.9 31.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.856 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 mt 65.47 83.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.047 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . 0.473 ' HB3' ' HB2' ' B' ' 81' ' ' LEU . 4.0 t0 -173.36 88.37 0.07 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.856 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.515 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 13.7 ptt? -53.02 -45.2 67.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.639 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.925 HG13 HD11 ' A' ' 81' ' ' LEU . 45.0 mm -65.22 -49.49 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.686 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.896 HD11 HG13 ' A' ' 80' ' ' ILE . 1.2 mm? -64.96 -21.22 66.8 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . 0.515 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 8.9 pttp -93.64 -24.66 17.81 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . 0.518 ' HE3' HD13 ' B' ' 80' ' ' ILE . 18.4 ptp -93.87 -15.22 25.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.621 0.248 . . . . 0.0 111.651 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.74 -65.33 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.726 0.298 . . . . 0.0 110.975 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 43.0 m 65.13 64.89 0.6 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.786 HD23 HG13 ' A' ' 89' ' ' ILE . 1.2 mp -149.43 32.74 0.72 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.738 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -113.15 -36.05 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.199 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.634 ' O ' HD13 ' B' ' 92' ' ' LEU . 2.3 m-20 -71.72 -13.45 61.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 111.047 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.651 HG13 HD23 ' A' ' 86' ' ' LEU . 26.0 mm -86.15 -57.43 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 94' ' ' THR . 30.1 tt0 -63.9 -19.08 64.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.354 178.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . 0.709 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -83.84 -67.55 0.78 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.653 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.634 HD13 ' O ' ' B' ' 88' ' ' ASP . 6.5 mp -49.31 -29.37 5.93 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.961 0.41 . . . . 0.0 110.37 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.476 ' HG ' ' HA ' ' A' ' 90' ' ' GLU . 4.3 mm? -85.14 -38.93 18.47 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.56 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.709 HG22 ' HA ' ' B' ' 91' ' ' ALA . 8.8 t -73.15 -7.7 52.55 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.983 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -112.92 -32.49 2.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.857 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 2.8 mm? -98.39 -7.39 28.83 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 117.023 0.411 . . . . 0.0 111.753 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 44.5 p90 31.82 42.11 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.843 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.4 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.396 -179.786 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.784 0.326 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.642 ' C ' HD12 ' A' ' 54' ' ' LEU . 18.6 p-80 -106.72 86.94 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.036 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.642 HD12 ' C ' ' A' ' 53' ' ' HIS . 11.1 mp -128.41 8.93 6.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.301 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.492 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.2 OUTLIER -52.8 -56.29 16.79 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.612 -179.796 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.66 -42.64 64.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.247 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.738 ' HB ' HG11 ' B' ' 57' ' ' VAL . 2.5 t -62.99 -38.71 82.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 CA-C-O 120.868 0.366 . . . . 0.0 111.114 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.679 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -61.22 -52.05 66.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.851 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 t -61.28 -20.22 62.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.291 177.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.437 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 11.4 tpp180 -69.66 -73.59 0.15 Allowed 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.346 -179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.845 HD13 HD22 ' A' ' 64' ' ' LEU . 4.2 mm? -62.63 -30.16 71.15 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.024 -1.071 . . . . 0.0 110.025 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.63 ' HB2' HD12 ' B' ' 61' ' ' LEU . 65.4 tt0 -62.5 -36.67 83.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.314 177.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.86 -15.28 48.77 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.845 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -86.27 -21.48 27.34 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.239 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.549 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 2.4 mm-40 -112.47 -18.32 12.46 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.331 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.29 89.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.405 ' N ' ' O ' ' A' ' 65' ' ' GLU . 7.0 mt 62.78 17.1 9.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.38 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.417 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 1.4 t80 -103.51 98.4 8.3 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.728 0.299 . . . . 0.0 111.026 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tt -177.19 -72.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.024 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.27 -39.02 0.15 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.915 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.637 HG23 HG12 ' A' ' 80' ' ' ILE . 16.6 mm -48.72 -26.99 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.566 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.73 77.19 0.39 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.847 0.356 . . . . 0.0 111.0 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.26 -46.66 1.34 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.575 2.183 . . . . 0.0 112.3 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.56 74.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.003 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 67.84 -69.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.058 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -70.66 138.67 50.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 pp -100.55 131.4 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.912 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.89 -38.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.954 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.06 -23.18 31.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.096 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.637 HG12 HG23 ' A' ' 71' ' ' ILE . 2.9 mp -62.6 -50.76 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.335 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.37 -11.13 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.475 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -88.55 -22.92 23.32 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.67 0.271 . . . . 0.0 111.191 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.5 mtm -116.1 -43.54 2.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.353 . . . . 0.0 111.002 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.53 89.69 3.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.869 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 87.6 p -158.35 154.81 27.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.08 13.69 18.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.261 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.84 17.21 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.246 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.793 ' O ' HD23 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -73.35 -14.61 61.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.07 179.779 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.415 ' CG2' ' HB ' ' B' ' 89' ' ' ILE . 10.6 mm -92.99 -50.37 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.421 ' OE2' HD23 ' B' ' 93' ' ' LEU . 3.8 tt0 -63.4 -21.86 66.54 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.93 -52.0 5.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.1 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 88' ' ' ASP . 2.3 mm? -52.33 -27.34 14.99 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.182 0.515 . . . . 0.0 109.619 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.596 HD12 HD12 ' B' ' 93' ' ' LEU . 0.2 OUTLIER -91.01 -36.93 13.78 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.04 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.21 -13.62 50.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.872 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.71 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.214 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.54 HD13 ' O ' ' A' ' 96' ' ' LEU . 0.2 OUTLIER -101.22 3.63 41.11 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.559 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.662 ' O ' HG12 ' A' ' 98' ' ' VAL . 21.2 p90 -41.84 133.22 2.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.596 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.662 HG12 ' O ' ' A' ' 97' ' ' PHE . 3.0 p . . . . . 0 N--CA 1.462 0.173 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.992 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.846 0.355 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.633 ' C ' HD12 ' B' ' 54' ' ' LEU . 18.3 p-80 -106.83 87.04 2.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.942 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.633 HD12 ' C ' ' B' ' 53' ' ' HIS . 11.0 mp -128.38 8.91 6.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.418 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.489 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -52.77 -56.33 16.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 111.523 -179.787 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.77 -42.59 65.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.227 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.738 HG11 ' HB ' ' A' ' 57' ' ' VAL . 2.4 t -62.82 -38.76 82.64 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-O 120.926 0.393 . . . . 0.0 111.172 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.659 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -61.26 -52.08 66.24 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 7.7 t -61.29 -20.26 62.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.381 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.445 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 11.5 tpp180 -69.69 -73.58 0.16 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.297 -179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.822 HD13 HD22 ' B' ' 64' ' ' LEU . 4.2 mm? -62.45 -30.45 71.25 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.081 -1.048 . . . . 0.0 110.018 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.634 ' HB2' HD12 ' A' ' 61' ' ' LEU . 65.3 tt0 -62.45 -36.49 82.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.372 177.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.94 -15.3 48.4 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.634 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.822 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -86.32 -21.5 27.24 Favored 'General case' 0 CA--C 1.523 -0.093 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.289 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 2.4 mm-40 -112.38 -18.43 12.47 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.384 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.23 89.19 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.952 0.406 . . . . 0.0 111.007 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.403 ' N ' ' O ' ' B' ' 65' ' ' GLU . 7.0 mt 62.92 16.87 9.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.359 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' B' ' 64' ' ' LEU . 1.4 t80 -103.32 98.34 8.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.758 0.314 . . . . 0.0 110.994 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tp -176.93 -73.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.998 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 -39.02 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.981 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.613 HG23 HG12 ' B' ' 80' ' ' ILE . 16.5 mm -48.57 -27.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.637 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.78 77.22 0.39 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.972 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.1 -46.59 1.43 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.525 2.15 . . . . 0.0 112.429 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.57 74.0 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 67.8 -67.83 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.145 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.28 138.17 49.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.979 0.418 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.17 129.98 46.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.828 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.55 -38.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.936 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.07 -23.2 32.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.172 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.613 HG12 HG23 ' B' ' 71' ' ' ILE . 2.9 mp -62.36 -50.95 77.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.376 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.4 -11.0 47.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.55 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -88.66 -22.77 23.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.739 0.304 . . . . 0.0 111.265 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.6 mtm -116.26 -43.52 2.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.91 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.57 89.74 3.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 86.5 p -158.4 154.8 27.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.833 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 mt -92.06 13.67 18.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.93 17.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.272 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.777 ' O ' HD23 ' B' ' 92' ' ' LEU . 0.3 OUTLIER -73.36 -14.54 61.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.102 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.415 ' HB ' ' CG2' ' A' ' 89' ' ' ILE . 10.6 mm -93.05 -50.34 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.425 ' OE2' HD23 ' A' ' 93' ' ' LEU . 3.8 tt0 -63.39 -21.82 66.52 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 177.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.04 -51.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.994 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.777 HD23 ' O ' ' B' ' 88' ' ' ASP . 2.3 mm? -52.35 -27.32 15.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.282 0.563 . . . . 0.0 109.597 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.596 HD12 HD12 ' A' ' 93' ' ' LEU . 0.2 OUTLIER -91.08 -36.84 13.78 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.078 178.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.18 -13.71 50.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.916 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.7 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.195 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.547 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -101.19 3.72 41.28 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.669 ' O ' HG12 ' B' ' 98' ' ' VAL . 21.4 p90 -41.82 133.16 2.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.698 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . 0.669 HG12 ' O ' ' B' ' 97' ' ' PHE . 3.0 p . . . . . 0 CA--C 1.532 0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.048 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' CB ' ' A' ' 55' ' ' THR . . . . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.564 0.221 . . . . 0.0 111.255 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.587 ' O ' HG21 ' B' ' 57' ' ' VAL . 14.4 m-70 63.6 -80.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.977 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.506 HD23 HG13 ' B' ' 57' ' ' VAL . 0.8 OUTLIER -94.78 -68.12 0.82 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.827 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.665 ' CB ' ' HB1' ' A' ' 52' ' ' ALA . 97.9 m 22.23 -86.17 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.8 mt-10 -60.06 -68.34 0.3 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.87 0.367 . . . . 0.0 111.495 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.6 HG21 ' O ' ' B' ' 53' ' ' HIS . 41.4 t -56.77 -21.78 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.672 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.692 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.9 pt-20 -70.31 -45.95 65.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.429 ' N ' ' HG2' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -68.52 -17.15 64.1 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.241 -0.89 . . . . 0.0 108.961 177.136 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 0.4 OUTLIER -73.76 -75.23 0.16 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.529 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.3 mm? -60.62 -29.11 69.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.072 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.659 ' HB2' HD12 ' B' ' 61' ' ' LEU . 3.5 tt0 -66.35 -38.2 87.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 59' ' ' SER . 6.2 ttt85 -66.83 -27.69 67.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.4 HD11 HD21 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -75.42 -27.31 58.96 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.601 178.649 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 8.4 tm-20 -78.29 -30.06 48.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.403 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.42 -31.14 69.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.712 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.49 -10.77 45.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.226 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 63.41 143.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.787 0.327 . . . . 0.0 110.983 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.441 HD11 ' OE1' ' B' ' 65' ' ' GLU . 2.3 mt -93.84 -63.49 1.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.845 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 31.5 mt -147.0 33.53 0.91 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.4 HD12 ' CZ ' ' B' ' 68' ' ' PHE . 23.6 mm -89.74 -58.81 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.218 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.3 112.24 46.7 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.975 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.51 -160.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.52 2.147 . . . . 0.0 112.285 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -134.56 162.1 33.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.348 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 56.52 -157.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.669 0.271 . . . . 0.0 110.927 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -78.41 -38.07 42.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.523 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.5 mt -46.94 114.47 0.85 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.076 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.487 ' OD2' HD11 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -130.72 106.28 8.36 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.13 0.49 . . . . 0.0 112.001 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.471 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -68.88 -39.2 79.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.615 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.91 -46.84 95.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.879 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.558 ' CD2' HD23 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -78.95 -25.75 43.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.923 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.471 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -84.59 -18.39 35.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.329 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 32.3 mtm -107.92 -23.29 12.1 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.539 ' CB ' HD13 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -58.19 -75.0 0.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.8 0.334 . . . . 0.0 111.304 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -174.27 127.65 0.35 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.116 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.47 HD23 ' O ' ' A' ' 81' ' ' LEU . 1.2 pp -158.43 29.34 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.585 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -97.42 -15.34 20.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.266 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 65.1 m-20 -70.6 -12.09 61.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.913 0.387 . . . . 0.0 111.163 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.644 ' HB ' HG21 ' B' ' 89' ' ' ILE . 11.2 mm -86.92 -57.51 4.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 94' ' ' THR . 40.0 tt0 -63.28 -19.21 64.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.179 177.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.597 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -83.27 -68.64 0.69 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.258 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.439 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.3 tt -47.52 -28.27 2.16 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.118 0.485 . . . . 0.0 110.263 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 89' ' ' ILE . 0.3 OUTLIER -83.25 -40.47 19.55 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.644 179.125 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.597 HG22 ' HA ' ' A' ' 91' ' ' ALA . 4.0 t -69.22 -9.53 53.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.889 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.94 -33.57 3.0 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.197 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.7 OUTLIER -87.77 -8.04 56.52 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 120.974 0.416 . . . . 0.0 111.058 179.282 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.434 ' CE1' ' HB ' ' B' ' 98' ' ' VAL . 0.3 OUTLIER 65.98 -152.66 0.24 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.297 -179.466 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.434 ' HB ' ' CE1' ' B' ' 97' ' ' PHE . 21.8 t . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 120.754 0.312 . . . . 0.0 111.114 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' CB ' ' B' ' 55' ' ' THR . . . . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.703 0.287 . . . . 0.0 111.136 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.6 ' O ' HG21 ' A' ' 57' ' ' VAL . 14.4 m-70 63.58 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.528 HD23 HG13 ' A' ' 57' ' ' VAL . 0.8 OUTLIER -94.74 -68.05 0.82 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.864 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.665 ' CB ' ' HB1' ' B' ' 52' ' ' ALA . 97.7 m 22.16 -86.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.8 mt-10 -60.0 -68.3 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 0.0 111.452 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.587 HG21 ' O ' ' A' ' 53' ' ' HIS . 41.7 t -56.84 -21.74 14.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.658 -179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.691 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.9 pt-20 -70.32 -46.0 65.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' HG2' ' B' ' 58' ' ' GLU . 0.3 OUTLIER -68.39 -17.3 64.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.006 177.138 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.526 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 0.4 OUTLIER -73.74 -75.2 0.16 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.553 -179.806 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.3 mm? -60.38 -29.38 68.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.144 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.662 ' HB2' HD12 ' A' ' 61' ' ' LEU . 3.6 tt0 -66.35 -38.09 86.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' B' ' 59' ' ' SER . 6.2 ttt85 -66.88 -27.76 67.77 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -27.29 59.1 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.544 0.687 . . . . 0.0 109.626 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.441 ' OE1' HD11 ' A' ' 69' ' ' LEU . 8.5 tm-20 -78.25 -30.12 48.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.382 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 -31.15 69.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.669 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.42 -10.8 45.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.353 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.4 ' CZ ' HD12 ' A' ' 71' ' ' ILE . 97.2 m-85 63.56 143.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.814 0.34 . . . . 0.0 110.949 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.0 tp -93.49 -63.62 1.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.984 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 30.6 mt -146.83 33.55 0.93 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.855 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -89.71 -58.87 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.166 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.24 112.22 46.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.952 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.43 -160.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.527 2.151 . . . . 0.0 112.313 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -134.22 164.0 28.36 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -52.65 96.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.168 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 179.06 -38.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.259 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.9 tp 179.66 148.53 0.27 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.426 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . 0.49 ' OD2' HD11 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -116.97 104.68 11.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.077 0.465 . . . . 0.0 110.808 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.478 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 0.0 OUTLIER -68.42 -39.06 81.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.621 -179.429 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -62.03 -46.78 95.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.558 HD23 ' CD2' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -79.06 -25.54 43.13 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.0 -178.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . 0.478 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 0.0 OUTLIER -84.84 -18.43 34.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.354 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 32.6 mtm -107.84 -23.18 12.16 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . 0.549 ' CB ' HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -58.39 -74.83 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.727 0.299 . . . . 0.0 111.257 -179.52 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . 0.452 ' C ' HD23 ' B' ' 86' ' ' LEU . 1.5 m -174.43 127.71 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.194 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.513 HD23 ' N ' ' B' ' 86' ' ' LEU . 0.4 OUTLIER -158.41 28.93 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.613 179.776 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -96.89 -15.45 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.284 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 65.4 m-20 -70.73 -12.01 61.3 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.077 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.644 HG21 ' HB ' ' A' ' 89' ' ' ILE . 11.2 mm -86.76 -57.65 4.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.582 ' O ' ' HB ' ' B' ' 94' ' ' THR . 40.0 tt0 -63.31 -19.19 64.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.187 177.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . 0.599 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -83.23 -68.63 0.69 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.345 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.435 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.3 tt -47.56 -28.33 2.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.959 0.409 . . . . 0.0 110.128 179.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.559 HD12 ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER -83.18 -40.5 19.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.679 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.599 HG22 ' HA ' ' B' ' 91' ' ' ALA . 4.0 t -69.1 -9.67 53.84 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.841 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.98 -33.54 3.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.128 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 0.7 OUTLIER -87.83 -8.02 56.46 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.008 0.432 . . . . 0.0 111.104 179.286 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.434 ' CE1' ' HB ' ' A' ' 98' ' ' VAL . 0.4 OUTLIER 66.01 -152.74 0.24 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.214 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . 0.434 ' HB ' ' CE1' ' A' ' 97' ' ' PHE . 21.9 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 111.15 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.064 0 CA-C-O 120.891 0.377 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.723 ' O ' HG22 ' B' ' 57' ' ' VAL . 0.0 OUTLIER 64.99 74.39 0.39 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.143 179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.606 HD23 ' HB2' ' A' ' 58' ' ' GLU . 1.5 mt -147.14 -96.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.516 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 0.2 OUTLIER 37.82 -142.73 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.099 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.71 -64.17 0.19 Allowed 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.703 HG22 ' O ' ' B' ' 53' ' ' HIS . 34.0 t -50.45 -37.21 14.59 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.657 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.3 pt-20 -61.36 -48.09 82.9 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.471 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -66.27 -15.64 63.37 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.381 177.802 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.452 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 29.2 ttm-85 -72.96 -71.35 0.31 Allowed 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.554 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.69 HD13 HD22 ' A' ' 64' ' ' LEU . 4.4 mm? -64.58 -27.29 68.85 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.851 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.448 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 1.9 tt0 -68.58 -33.44 74.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.57 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.0 OUTLIER -81.4 -19.37 42.73 Favored 'General case' 0 C--O 1.231 0.102 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.452 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.69 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -82.98 -24.01 33.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.253 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' B' ' 65' ' ' GLU . 0.6 OUTLIER -93.93 -65.14 1.01 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.655 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.449 ' O ' ' CB ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.33 133.89 53.55 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.471 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.5 OUTLIER 83.4 -45.73 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.777 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.65 88.7 3.29 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.969 0.414 . . . . 0.0 110.669 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.07 161.2 38.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.738 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.63 -19.49 58.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.273 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.581 ' O ' HG22 ' A' ' 71' ' ' ILE . 15.7 mm -125.05 27.51 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.643 0.259 . . . . 0.0 111.633 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.435 ' CE2' ' HB2' ' A' ' 74' ' ' ARG . 5.1 p90 -58.04 137.29 84.03 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.006 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.468 2.112 . . . . 0.0 112.335 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.435 ' HB2' ' CE2' ' A' ' 72' ' ' PHE . 0.0 OUTLIER -169.06 -65.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -70.94 0.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 61.39 154.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.78 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 pp -150.11 26.64 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.136 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 62.56 69.52 0.6 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.935 0.397 . . . . 0.0 110.893 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 29.0 mtp -65.27 -49.16 70.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.692 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.421 HG22 HD11 ' B' ' 81' ' ' LEU . 2.0 mp -76.6 -41.19 34.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.727 HD12 HD12 ' B' ' 81' ' ' LEU . 1.0 OUTLIER -60.15 -30.15 69.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.661 179.665 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.45 -29.75 18.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.392 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.81 -24.24 63.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.769 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.6 96.63 10.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.5 m -54.06 109.92 0.54 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.179 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 pp -139.39 26.39 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.56 -21.88 13.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -7.01 49.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 0.0 111.105 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.696 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.6 mp -91.79 -54.05 7.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.44 ' HG3' HG21 ' B' ' 89' ' ' ILE . 0.0 OUTLIER -66.63 -20.88 66.09 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.2 178.014 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -56.83 3.16 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.265 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.522 HD23 HG11 ' A' ' 98' ' ' VAL . 32.8 tp -54.76 -24.09 20.91 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.694 ' HG ' HG12 ' A' ' 98' ' ' VAL . 11.2 mt -92.24 -39.53 11.48 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.544 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.65 -13.85 61.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.146 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.11 -40.89 0.46 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.422 -0.894 . . . . 0.0 113.345 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 96' ' ' LEU . 3.9 mm? -111.71 -0.44 16.0 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 30.4 p90 39.53 53.4 2.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.603 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.694 HG12 ' HG ' ' A' ' 93' ' ' LEU . 11.6 p . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.357 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.817 0.342 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.703 ' O ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 65.06 74.4 0.39 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.033 179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.591 HD23 ' HB2' ' B' ' 58' ' ' GLU . 1.5 mt -147.1 -96.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.5 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.52 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 0.2 OUTLIER 37.67 -142.77 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 179.077 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.67 -64.15 0.19 Allowed 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.723 HG22 ' O ' ' A' ' 53' ' ' HIS . 34.6 t -50.6 -37.14 15.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.779 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.667 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.3 pt-20 -61.28 -48.09 83.02 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.468 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 0.2 OUTLIER -66.33 -15.46 63.27 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.521 177.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.465 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 28.8 ttm-85 -73.01 -71.26 0.31 Allowed 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.63 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.694 HD13 HD22 ' B' ' 64' ' ' LEU . 4.4 mm? -64.53 -27.45 68.97 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.842 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.445 ' HB2' HD12 ' A' ' 61' ' ' LEU . 1.9 tt0 -68.53 -33.52 74.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.503 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.0 OUTLIER -81.49 -19.2 42.78 Favored 'General case' 0 C--O 1.231 0.109 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.616 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.694 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -83.01 -23.95 33.05 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.244 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -94.06 -65.15 1.01 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.599 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 67' ' ' LEU . 0.0 OUTLIER -64.4 133.97 53.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.214 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.465 HD13 ' O ' ' B' ' 67' ' ' LEU . 0.5 OUTLIER 83.33 -45.74 0.12 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.756 -179.328 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.68 88.48 3.23 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.867 0.365 . . . . 0.0 110.586 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.573 HD13 ' H ' ' B' ' 70' ' ' LEU . 0.2 OUTLIER -158.11 160.09 36.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.59 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.573 ' H ' HD13 ' B' ' 69' ' ' LEU . 14.7 mt -59.64 -19.56 50.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.273 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.581 HG22 ' O ' ' B' ' 71' ' ' ILE . 15.7 mm -124.98 27.53 2.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.595 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . 0.435 ' CE2' ' HB2' ' B' ' 74' ' ' ARG . 5.1 p90 -58.04 137.34 84.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.966 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.568 2.179 . . . . 0.0 112.283 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . 0.435 ' HB2' ' CE2' ' B' ' 72' ' ' PHE . 0.0 OUTLIER -168.96 -65.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.114 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -125.31 122.83 37.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.19 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 p30 -66.89 173.73 3.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.789 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp 177.56 -30.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.177 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 64.17 69.24 0.53 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.902 0.382 . . . . 0.0 110.696 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 29.1 mtp -65.16 -49.3 70.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.675 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.42 HG22 HD11 ' A' ' 81' ' ' LEU . 2.0 mp -76.43 -41.25 35.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.727 HD12 HD12 ' A' ' 81' ' ' LEU . 1.0 OUTLIER -60.15 -30.19 69.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.558 179.765 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.58 -29.7 18.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.296 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.76 -24.3 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.712 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.64 96.57 10.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.638 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 5.4 m -54.01 109.82 0.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.601 ' O ' HD12 ' B' ' 86' ' ' LEU . 3.2 pp -139.43 26.67 2.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.992 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.74 -21.92 13.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.922 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' B' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -6.97 49.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.061 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.694 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.6 mp -91.79 -54.03 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.414 ' HG3' HG21 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -66.61 -20.8 66.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.237 177.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.35 -56.69 3.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.247 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.498 HD23 HG11 ' B' ' 98' ' ' VAL . 33.4 tp -54.82 -24.1 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.97 0.414 . . . . 0.0 109.908 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.7 ' HG ' HG12 ' B' ' 98' ' ' VAL . 11.1 mt -92.28 -39.57 11.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.47 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.94 61.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.13 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.06 -40.84 0.47 Allowed Glycine 0 CA--C 1.519 0.3 0 C-N-CA 120.42 -0.895 . . . . 0.0 113.354 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.76 -0.45 15.95 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 30.0 p90 39.52 53.43 2.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.571 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . 0.7 HG12 ' HG ' ' B' ' 93' ' ' LEU . 11.6 p . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.353 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.928 0.394 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.619 ' O ' HG21 ' B' ' 57' ' ' VAL . 3.1 m-70 -116.75 -66.49 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.63 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.865 HD23 ' OE1' ' A' ' 58' ' ' GLU . 5.0 mp -54.62 -81.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.426 HG22 ' O ' ' A' ' 54' ' ' LEU . 13.2 t 42.72 -151.19 0.03 OUTLIER 'General case' 0 C--O 1.24 0.576 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 178.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 15.1 mt-10 -38.02 -41.46 0.56 Allowed 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.575 -178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.61 HG21 ' O ' ' B' ' 53' ' ' HIS . 51.6 t -64.44 -42.74 96.16 Favored 'Isoleucine or valine' 0 C--O 1.251 1.143 0 CA-C-O 121.362 0.601 . . . . 0.0 110.922 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.942 ' O ' HD23 ' B' ' 61' ' ' LEU . 1.1 pt-20 -59.04 -54.5 46.34 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.503 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 94.0 p -61.67 -17.56 56.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.657 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.464 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.8 -71.49 0.22 Allowed 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.871 -179.115 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.959 HD23 ' O ' ' B' ' 58' ' ' GLU . 0.0 OUTLIER -67.8 -19.97 65.14 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.787 -179.335 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.406 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.21 77.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.901 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.6 mtp85 -85.78 -18.66 32.34 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.215 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.803 HD13 ' CD1' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -75.85 -34.22 60.06 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.144 0.497 . . . . 0.0 110.407 179.639 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.551 ' N ' HD23 ' A' ' 64' ' ' LEU . 0.5 OUTLIER -96.49 -28.84 14.22 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.129 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.03 42.31 3.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.127 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.31 119.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.26 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HB2' ' CD2' ' B' ' 68' ' ' PHE . 4.0 t80 -151.4 124.0 8.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.985 0.422 . . . . 0.0 110.971 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tp -175.23 -39.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.07 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -103.82 26.01 9.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 21.6 mt -114.01 -24.87 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.173 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 63.45 123.36 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.732 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -84.17 87.11 1.19 Allowed 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.683 2.255 . . . . 0.0 112.654 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.7 mtp-105 56.47 34.12 23.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.243 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.85 104.54 14.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 75.4 -76.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.494 HD22 HD11 ' B' ' 80' ' ' ILE . 6.6 mp 53.95 68.2 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.026 0.441 . . . . 0.0 110.88 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -114.3 -19.02 11.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.674 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.1 -40.81 74.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.742 0.306 . . . . 0.0 111.045 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mm -67.3 -44.11 87.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.117 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.831 HD12 HD12 ' B' ' 81' ' ' LEU . 3.7 mp -65.27 -24.3 67.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.921 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.07 -26.81 22.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.937 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 39.7 mtp -85.17 -20.28 30.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.101 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.593 ' HB3' HD21 ' B' ' 81' ' ' LEU . 3.9 t0 -99.5 28.02 4.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.77 0.319 . . . . 0.0 110.98 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 168.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.061 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.481 ' CA ' HD13 ' A' ' 89' ' ' ILE . 2.5 mt -176.09 -40.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.897 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.92 -30.62 22.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.811 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.687 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -71.06 -9.93 58.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.169 179.72 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.707 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.4 mp -91.65 -55.97 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.54 -20.9 65.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.524 -0.762 . . . . 0.0 108.982 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.2 -49.98 6.91 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.883 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.687 HD12 ' O ' ' A' ' 88' ' ' ASP . 4.4 mt -53.97 -26.75 27.43 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 3.8 mm? -91.9 -36.88 13.22 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.997 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.19 -14.82 57.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.964 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.47 -29.79 1.26 Allowed Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.498 -0.858 . . . . 0.0 113.21 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.649 ' O ' HG23 ' A' ' 98' ' ' VAL . 1.0 OUTLIER -100.12 2.87 43.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.962 0.381 . . . . 0.0 111.956 -179.521 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.423 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 24.5 p90 -38.89 137.54 0.65 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.679 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 96' ' ' LEU . 21.7 t . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.991 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.834 0.349 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.61 ' O ' HG21 ' A' ' 57' ' ' VAL . 3.1 m-70 -116.71 -66.27 1.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.725 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.861 HD23 ' OE1' ' B' ' 58' ' ' GLU . 5.0 mp -54.72 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.726 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.433 HG22 ' O ' ' B' ' 54' ' ' LEU . 13.3 t 42.81 -151.25 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.405 ' N ' HG23 ' B' ' 55' ' ' THR . 14.8 mt-10 -38.04 -41.37 0.56 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.613 -178.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.619 HG21 ' O ' ' A' ' 53' ' ' HIS . 52.5 t -64.46 -42.87 96.52 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.297 0.57 . . . . 0.0 110.798 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.959 ' O ' HD23 ' A' ' 61' ' ' LEU . 1.1 pt-20 -58.97 -54.65 44.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.509 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 94.1 p -61.47 -17.73 55.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.728 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.65 -71.63 0.21 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.857 -179.132 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.942 HD23 ' O ' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -67.69 -19.97 65.23 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.834 -179.281 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.44 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.25 77.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.886 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.6 mtp85 -85.7 -18.69 32.38 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.169 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.803 HD13 ' CD1' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -75.88 -34.16 59.99 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.14 0.495 . . . . 0.0 110.365 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.549 ' N ' HD23 ' B' ' 64' ' ' LEU . 0.5 OUTLIER -96.64 -28.78 14.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.115 179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 65.83 42.47 3.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.22 118.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.465 ' CD2' ' HB2' ' A' ' 68' ' ' PHE . 4.0 t80 -151.28 123.64 8.34 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.024 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -174.75 -39.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.075 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mt -104.16 26.14 9.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.159 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.424 ' HB ' ' CE1' ' B' ' 68' ' ' PHE . 21.4 mt -113.98 -24.82 3.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.246 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 63.54 123.28 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.696 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -84.3 86.92 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.778 2.318 . . . . 0.0 112.552 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.0 mtp-105 53.88 24.45 4.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.805 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -83.79 -73.55 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.342 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.91 88.16 2.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.937 0.398 . . . . 0.0 110.755 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.63 67.97 0.92 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -105.64 -19.8 13.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -40.75 75.29 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.494 HD11 HD22 ' A' ' 77' ' ' LEU . 34.9 mm -67.34 -44.2 87.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.018 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.831 HD12 HD12 ' A' ' 81' ' ' LEU . 3.6 mp -65.33 -24.09 67.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.19 -26.82 22.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.98 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 39.8 mtp -85.1 -20.37 30.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.15 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . 0.582 ' HB3' HD21 ' A' ' 81' ' ' LEU . 3.8 t0 -99.48 28.13 4.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.073 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t 57.45 168.05 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.48 ' CA ' HD13 ' B' ' 89' ' ' ILE . 0.5 OUTLIER -176.06 -40.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.926 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.75 -30.74 22.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.91 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.681 ' O ' HD12 ' B' ' 92' ' ' LEU . 0.2 OUTLIER -70.89 -10.13 59.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.688 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.5 mp -91.57 -56.01 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -62.52 -20.9 65.08 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.045 177.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 -49.92 6.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.0 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.681 HD12 ' O ' ' B' ' 88' ' ' ASP . 4.4 mt -54.01 -26.74 27.77 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 3.8 mm? -91.84 -36.92 13.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.013 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.12 -14.87 57.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.986 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.41 -29.96 1.24 Allowed Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.199 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.648 ' O ' HG23 ' B' ' 98' ' ' VAL . 1.0 OUTLIER -100.04 2.87 43.76 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.583 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 24.4 p90 -38.82 137.5 0.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.643 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . 0.648 HG23 ' O ' ' B' ' 96' ' ' LEU . 21.7 t . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.929 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.81 0.338 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -126.62 85.38 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.776 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.59 HD12 HG13 ' B' ' 57' ' ' VAL . 19.6 tp -172.7 -100.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.017 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.493 ' C ' ' O ' ' A' ' 54' ' ' LEU . 38.4 m 6.35 -72.75 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -59.96 -68.52 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.997 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.593 HG13 HD12 ' B' ' 54' ' ' LEU . 24.5 t -55.53 -48.56 77.2 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.603 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.2 pt-20 -51.72 -47.29 64.06 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.387 0.613 . . . . 0.0 109.469 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.414 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 4.9 t -67.61 -19.51 65.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.577 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.445 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -69.21 -68.53 0.4 Allowed 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.466 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.668 ' HG ' ' HB2' ' B' ' 62' ' ' GLU . 3.6 mm? -62.91 -42.46 99.8 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.802 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.643 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 69.7 tt0 -50.8 -35.96 34.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.255 177.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.45 -26.59 46.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.913 0.387 . . . . 0.0 110.035 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -27.16 68.3 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.3 0.571 . . . . 0.0 109.742 179.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 66' ' ' GLN . 25.2 tt0 -99.56 -21.23 15.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.882 178.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 65' ' ' GLU . 17.3 pt20 50.53 35.26 10.92 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.482 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.445 ' O ' ' CB ' ' A' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 11.0 7.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.925 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.817 ' CE1' HD22 ' B' ' 69' ' ' LEU . 0.4 OUTLIER 158.58 137.69 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.471 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.877 ' HG ' HG22 ' A' ' 71' ' ' ILE . 0.7 OUTLIER -66.42 -165.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.34 179.458 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.74 -15.51 58.74 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.877 HG22 ' HG ' ' A' ' 69' ' ' LEU . 0.7 OUTLIER -57.18 -28.86 30.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.716 0.293 . . . . 0.0 111.539 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.19 92.95 5.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.164 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.75 -7.6 21.04 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.579 2.186 . . . . 0.0 112.663 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 65.9 49.71 1.61 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.351 . . . . 0.0 110.918 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -176.27 -51.04 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -108.59 135.07 50.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.961 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.401 ' O ' HD12 ' A' ' 77' ' ' LEU . 1.6 pp -109.36 30.12 6.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.96 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 30.54 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -49.72 57.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.415 HG13 HD12 ' A' ' 71' ' ' ILE . 37.9 mm -61.72 -45.51 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.989 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 mt -66.11 -30.4 70.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.524 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -74.86 -28.97 60.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.855 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.03 -73.93 0.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.577 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.39 116.4 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.624 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.554 ' HB2' HD21 ' B' ' 86' ' ' LEU . 0.7 OUTLIER 75.49 -161.93 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.777 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 64.92 26.07 12.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.751 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -148.94 -40.88 0.15 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.912 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.22 -8.3 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.881 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.534 HG21 ' HB ' ' B' ' 89' ' ' ILE . 13.0 mm -89.36 -56.87 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.524 ' O ' ' HB ' ' A' ' 94' ' ' THR . 2.5 tm-20 -64.89 -19.88 66.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.493 178.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.787 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.48 -58.74 2.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.641 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 25.5 tp -55.85 -24.27 35.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.289 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.572 ' HG ' HG12 ' A' ' 98' ' ' VAL . 1.0 OUTLIER -92.38 -39.79 11.25 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.066 179.668 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.787 HG22 ' HA ' ' A' ' 91' ' ' ALA . 11.4 t -69.94 -11.49 60.91 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.898 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.33 -35.85 1.06 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.753 -0.737 . . . . 0.0 113.19 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 96' ' ' LEU . 0.2 OUTLIER -95.71 -5.42 42.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 117.015 0.408 . . . . 0.0 112.015 -179.565 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.426 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 25.6 p90 37.26 93.97 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.033 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.572 HG12 ' HG ' ' A' ' 93' ' ' LEU . 12.2 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.184 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.835 0.35 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -126.54 85.43 2.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.593 HD12 HG13 ' A' ' 57' ' ' VAL . 19.7 tp -172.81 -100.37 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.028 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.483 ' C ' ' O ' ' B' ' 54' ' ' LEU . 38.9 m 6.46 -72.87 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -59.95 -68.53 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.007 -178.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.59 HG13 HD12 ' A' ' 54' ' ' LEU . 25.0 t -55.68 -48.17 78.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.714 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.622 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 pt-20 -52.01 -47.28 65.04 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.425 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 4.8 t -67.41 -19.56 65.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.666 178.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.452 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -69.26 -68.59 0.39 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.426 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.643 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 3.6 mm? -62.9 -42.43 99.78 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 119.377 -0.929 . . . . 0.0 108.742 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.668 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 69.7 tt0 -50.85 -35.83 34.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.249 177.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.6 -26.57 45.43 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.918 0.39 . . . . 0.0 110.014 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -27.2 68.37 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.336 0.588 . . . . 0.0 109.723 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.423 ' O ' ' CG ' ' B' ' 66' ' ' GLN . 25.3 tt0 -99.54 -21.35 15.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.837 178.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' B' ' 65' ' ' GLU . 17.3 pt20 50.53 35.32 11.07 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.47 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.45 ' O ' ' CB ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 10.8 7.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.958 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.548 ' CE1' HD22 ' A' ' 69' ' ' LEU . 0.3 OUTLIER 158.78 138.61 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.632 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.817 HD22 ' CE1' ' A' ' 68' ' ' PHE . 2.4 tp -66.06 -166.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.439 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 15.8 mt -63.7 -15.44 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.345 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.441 HD12 HG13 ' B' ' 80' ' ' ILE . 0.7 OUTLIER -57.24 -28.66 30.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.715 0.293 . . . . 0.0 111.549 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.28 93.09 5.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.169 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.82 -7.63 21.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.62 2.213 . . . . 0.0 112.695 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 65.74 49.27 1.75 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.922 0.391 . . . . 0.0 110.836 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -170.64 -61.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.835 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -105.35 139.47 39.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.754 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.03 34.16 3.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.5 30.41 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -49.75 56.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.441 HG13 HD12 ' B' ' 71' ' ' ILE . 38.0 mm -61.72 -45.49 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mt -66.05 -30.39 70.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.585 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -75.0 -28.82 60.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.04 -73.92 0.43 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.651 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.36 116.35 10.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.597 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 75.67 -162.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.692 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' ' 85' ' ' SER . 1.1 mm? 64.85 26.18 12.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.847 0.356 . . . . 0.0 110.723 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -148.96 -40.91 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.802 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.27 -8.16 51.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.884 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.534 ' HB ' HG21 ' A' ' 89' ' ' ILE . 12.9 mm -89.37 -56.96 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.521 ' O ' ' HB ' ' B' ' 94' ' ' THR . 2.4 tm-20 -64.93 -19.91 66.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.432 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . 0.78 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.33 -58.69 2.49 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.78 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 25.8 tp -55.8 -24.36 35.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.288 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.586 ' HG ' HG12 ' B' ' 98' ' ' VAL . 1.0 OUTLIER -92.25 -39.89 11.27 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.08 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.78 HG22 ' HA ' ' B' ' 91' ' ' ALA . 11.5 t -69.97 -11.47 60.9 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.895 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.4 -35.89 1.05 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.106 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.427 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -95.62 -5.39 42.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 117.162 0.481 . . . . 0.0 112.105 -179.648 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.431 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 25.9 p90 37.25 94.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.13 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . 0.586 HG12 ' HG ' ' B' ' 93' ' ' LEU . 12.1 p . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.19 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.793 0.33 . . . . 0.0 111.328 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -157.27 27.46 0.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -101.13 -0.46 36.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.59 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.518 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -56.32 -53.41 57.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.79 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.14 -42.05 63.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.75 ' HB ' HG11 ' B' ' 57' ' ' VAL . 2.9 t -62.59 -41.1 90.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.628 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.594 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 2.4 mt-10 -56.61 -64.1 0.98 Allowed 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.6 m -52.88 -20.51 3.37 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.118 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.01 -73.25 0.15 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.159 -179.31 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.874 ' CD1' HD13 ' A' ' 64' ' ' LEU . 3.6 mm? -61.83 -24.42 66.88 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.145 -1.022 . . . . 0.0 110.208 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.28 -37.19 86.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.49 177.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -20.39 53.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.522 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.874 HD13 ' CD1' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -74.47 -32.07 62.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.46 0.647 . . . . 0.0 110.386 179.404 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.574 ' N ' HD23 ' A' ' 64' ' ' LEU . 3.3 mm-40 -92.81 -23.71 18.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.623 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -58.74 -39.03 79.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.017 0.437 . . . . 0.0 110.366 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.554 ' O ' HD23 ' A' ' 67' ' ' LEU . 9.1 tt -76.46 -11.42 59.88 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.969 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 31.5 t80 76.57 130.93 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.91 0.386 . . . . 0.0 111.123 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -145.15 61.04 1.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.737 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.7 52.47 13.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.149 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.408 ' CD1' ' HG2' ' B' ' 66' ' ' GLN . 6.5 tp -99.43 -41.08 9.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.097 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.407 ' N ' HG23 ' A' ' 71' ' ' ILE . 2.9 t80 -78.57 113.52 35.31 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.836 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.1 134.36 59.73 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.361 2.041 . . . . 0.0 112.255 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.6 mtm180 -156.38 89.01 1.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -73.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -95.51 121.57 37.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.226 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp 53.9 100.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.128 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.623 ' CB ' HD21 ' A' ' 81' ' ' LEU . 13.1 m-20 -75.69 96.3 3.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 28.5 mtt -62.5 -25.82 68.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.901 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.03 -55.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.403 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.711 HD12 HD22 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -81.52 -15.68 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -179.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.37 -25.98 38.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.814 0.34 . . . . 0.0 110.744 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.54 -22.86 12.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.89 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.04 -68.46 0.44 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.746 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 p -147.88 -92.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.96 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.711 HD22 HD12 ' A' ' 81' ' ' LEU . 12.8 tp 44.78 29.78 0.47 Allowed 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 120.783 0.325 . . . . 0.0 111.414 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.77 -33.42 1.82 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.361 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.77 -10.29 57.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.668 0.27 . . . . 0.0 111.242 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 21.3 mm -88.71 -53.89 8.76 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.473 ' O ' ' HB ' ' A' ' 94' ' ' THR . 33.2 tt0 -67.49 -16.81 64.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.184 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.825 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -88.02 -47.86 8.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.212 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 10.4 mt -64.08 -24.19 67.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.159 0.504 . . . . 0.0 109.756 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.521 HD13 ' O ' ' A' ' 97' ' ' PHE . 1.3 mm? -91.26 -36.85 13.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.795 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.825 HG22 ' HA ' ' A' ' 91' ' ' ALA . 9.0 t -75.51 -13.02 60.35 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.0 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.65 -31.11 1.86 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.251 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.96 -0.11 12.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 117.151 0.475 . . . . 0.0 112.144 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.542 ' HD2' HG23 ' A' ' 98' ' ' VAL . 0.1 OUTLIER 36.14 -92.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.279 179.485 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.542 HG23 ' HD2' ' A' ' 97' ' ' PHE . 21.6 t . . . . . 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.252 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.843 0.354 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -157.28 27.46 0.3 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.986 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.737 HD22 ' O ' ' B' ' 54' ' ' LEU . 0.0 OUTLIER -101.25 -0.44 35.81 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.605 -179.876 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.522 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -56.33 -53.38 57.94 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.204 0.526 . . . . 0.0 110.778 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.16 -42.13 63.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.662 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.75 HG11 ' HB ' ' A' ' 57' ' ' VAL . 2.9 t -62.65 -40.96 90.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.646 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 2.4 mt-10 -56.66 -64.03 1.0 Allowed 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 43.5 m -52.93 -20.45 3.38 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.138 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.456 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.13 -73.14 0.15 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.156 -179.331 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.883 HD13 HD13 ' B' ' 64' ' ' LEU . 3.6 mm? -61.9 -24.34 66.89 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.2 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -65.5 -37.05 85.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -20.4 53.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.566 178.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.883 HD13 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -74.63 -31.95 62.14 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.36 0.6 . . . . 0.0 110.328 179.506 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.583 ' N ' HD23 ' B' ' 64' ' ' LEU . 3.3 mm-40 -92.81 -23.62 18.78 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.718 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 0.408 ' HG2' ' CD1' ' A' ' 71' ' ' ILE . 7.6 mt-30 -58.77 -39.16 80.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.309 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.573 ' O ' HD23 ' B' ' 67' ' ' LEU . 9.2 tt -76.43 -11.41 59.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.025 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' B' ' 67' ' ' LEU . 31.3 t80 76.48 130.99 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.877 0.37 . . . . 0.0 111.216 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.48 60.98 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.0 52.46 12.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.5 tp -99.37 -41.07 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.248 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -78.48 113.54 35.26 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.905 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.05 134.17 58.64 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.416 2.078 . . . . 0.0 112.266 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -155.85 87.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.798 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -163.67 102.33 0.92 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.468 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 66.45 127.08 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.471 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.74 69.56 0.5 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.02 0.438 . . . . 0.0 110.704 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . 0.626 ' CB ' HD21 ' B' ' 81' ' ' LEU . 12.9 m-20 -72.02 97.25 1.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.643 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 28.2 mtt -62.64 -25.7 68.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.1 -55.77 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.346 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.626 HD21 ' CB ' ' B' ' 78' ' ' ASP . 0.4 OUTLIER -81.71 -15.53 54.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.484 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.41 -26.01 38.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.788 0.327 . . . . 0.0 110.75 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.53 -22.82 12.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.0 -68.57 0.43 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.715 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 p -147.86 -92.2 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.91 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.507 HD22 HD12 ' B' ' 81' ' ' LEU . 9.1 tp 44.82 29.76 0.48 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.79 0.328 . . . . 0.0 111.358 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.92 -33.35 1.79 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.387 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.72 -10.33 57.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.34 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 20.9 mm -88.48 -53.9 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.456 ' O ' ' HB ' ' B' ' 94' ' ' THR . 33.2 tt0 -67.65 -16.78 64.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.185 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . 0.814 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -88.0 -47.73 8.31 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.332 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.21 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.135 0.493 . . . . 0.0 109.713 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.531 HD13 ' O ' ' B' ' 97' ' ' PHE . 1.3 mm? -91.29 -36.95 13.58 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.773 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.814 HG22 ' HA ' ' B' ' 91' ' ' ALA . 9.1 t -75.44 -13.1 60.37 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.033 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.59 -31.04 1.88 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.398 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.9 -0.11 12.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 117.154 0.477 . . . . 0.0 112.273 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.531 ' O ' HD13 ' B' ' 93' ' ' LEU . 0.1 OUTLIER 36.05 -92.87 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.272 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . 0.528 HG23 ' HD2' ' B' ' 97' ' ' PHE . 21.5 t . . . . . 0 C--N 1.332 -0.155 0 CA-C-O 120.844 0.354 . . . . 0.0 111.308 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.822 0.344 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.535 ' C ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -144.87 136.97 25.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.034 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.596 HD12 ' N ' ' A' ' 54' ' ' LEU . 5.0 mp -110.5 -57.52 2.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.618 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.423 ' C ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -21.04 -55.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 1.7 mm-40 -58.68 -50.84 72.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.266 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.619 HG12 ' N ' ' B' ' 58' ' ' GLU . 6.1 t -63.92 -53.81 39.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.39 -179.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.786 ' HB2' HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.58 -62.39 1.68 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.576 ' N ' HD22 ' B' ' 61' ' ' LEU . 29.9 t -48.72 -28.03 3.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.64 177.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 8.7 tpt180 -60.74 -63.86 1.15 Allowed 'General case' 0 C--O 1.242 0.694 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.889 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.925 HD23 ' HB2' ' B' ' 62' ' ' GLU . 1.0 OUTLIER -63.03 -18.22 63.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 118.1 -1.44 . . . . 0.0 109.71 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.908 ' HB2' HD23 ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.34 -37.66 87.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -68.91 -31.6 70.62 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -63.21 -30.15 71.35 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.086 177.67 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.448 ' N ' HD23 ' A' ' 64' ' ' LEU . 0.6 OUTLIER -80.18 -31.44 38.81 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.049 179.159 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -55.74 -35.93 66.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.56 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.01 -29.99 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.524 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.58 102.96 0.78 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.772 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.1 -72.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.26 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.45 ' O ' HG22 ' A' ' 71' ' ' ILE . 4.9 mt -140.48 53.48 1.62 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.85 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 70' ' ' LEU . 7.1 tt 42.84 32.18 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.54 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.15 67.49 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.2 163.91 1.42 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.523 2.149 . . . . 0.0 112.35 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.21 89.34 7.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.404 ' HB3' HD13 ' A' ' 77' ' ' LEU . 4.2 tp10 -159.96 152.08 20.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -80.87 90.18 5.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.404 HD13 ' HB3' ' A' ' 75' ' ' GLU . 6.9 mp -118.91 175.36 5.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.793 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.434 ' HB2' ' HB2' ' A' ' 81' ' ' LEU . 7.0 p-10 -137.08 59.71 1.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -45.92 77.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.015 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -57.16 -39.79 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.861 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.803 HD12 HD12 ' B' ' 81' ' ' LEU . 9.3 mp -71.38 -27.91 63.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.788 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.16 -23.3 44.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 16.4 mtp -95.96 -21.11 18.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.247 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.57 -2.74 37.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.412 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.55 143.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.946 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.531 HD22 HD23 ' A' ' 81' ' ' LEU . 9.7 tp -149.62 26.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.958 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -116.14 -15.96 11.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.287 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.569 ' O ' HD23 ' A' ' 92' ' ' LEU . 67.4 m-20 -71.08 -10.06 59.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.649 0.262 . . . . 0.0 111.22 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.732 ' O ' HD12 ' A' ' 93' ' ' LEU . 20.2 mm -89.68 -55.36 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.501 ' O ' ' HB ' ' A' ' 94' ' ' THR . 20.0 tt0 -66.23 -17.58 64.83 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.275 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.774 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.94 -55.35 3.8 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.555 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.569 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.2 mm? -58.98 -23.44 61.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.115 0.483 . . . . 0.0 110.051 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.732 HD12 ' O ' ' A' ' 89' ' ' ILE . 0.4 OUTLIER -91.43 -40.92 11.15 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.046 179.774 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.774 HG22 ' HA ' ' A' ' 91' ' ' ALA . 10.5 t -71.01 -11.73 61.13 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.226 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.71 -33.64 1.27 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.122 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.01 -2.86 33.4 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.41 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 17.6 p90 40.35 79.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.688 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.6 t . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.109 -179.963 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.745 0.307 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.544 ' C ' HD12 ' B' ' 54' ' ' LEU . 0.0 OUTLIER -144.85 137.02 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.043 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.588 ' N ' HD12 ' B' ' 54' ' ' LEU . 5.0 mp -110.54 -57.51 2.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.641 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.434 ' C ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -20.98 -55.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 179.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 1.7 mm-40 -58.7 -50.86 72.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.841 0.353 . . . . 0.0 111.287 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.618 HG12 ' N ' ' A' ' 58' ' ' GLU . 6.1 t -63.8 -53.84 39.43 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.767 ' HB2' HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.56 -62.4 1.68 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.592 ' N ' HD22 ' A' ' 61' ' ' LEU . 30.1 t -48.73 -28.14 3.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.567 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.527 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 8.7 tpt180 -60.6 -63.83 1.16 Allowed 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.991 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.908 HD23 ' HB2' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -63.18 -18.07 63.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.111 -1.436 . . . . 0.0 109.808 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.925 ' HB2' HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -65.38 -37.67 87.71 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 175.616 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -68.96 -31.52 70.45 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.574 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -63.16 -30.29 71.47 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.05 177.653 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.452 ' N ' HD23 ' B' ' 64' ' ' LEU . 0.6 OUTLIER -80.21 -31.32 38.68 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.638 -1.165 . . . . 0.0 110.125 179.147 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -55.86 -35.87 66.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.563 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -29.87 63.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.541 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.64 103.2 0.83 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.647 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 43.7 tp -54.26 -72.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.23 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.441 ' O ' HG22 ' B' ' 71' ' ' ILE . 4.8 mt -140.36 53.46 1.63 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.907 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.441 HG22 ' O ' ' B' ' 70' ' ' LEU . 7.1 tt 42.88 32.1 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.651 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.11 67.58 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.927 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.27 163.92 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.596 2.197 . . . . 0.0 112.28 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.15 89.32 7.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -159.98 151.51 19.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.75 90.07 5.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.58 175.96 5.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . 0.429 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 6.9 p-10 -137.33 59.69 1.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.857 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -45.83 77.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.091 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.7 mm -57.14 -39.83 69.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.803 HD12 HD12 ' A' ' 81' ' ' LEU . 9.3 mp -71.32 -27.99 63.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.753 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.1 -23.38 44.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.162 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 16.3 mtp -95.93 -21.13 18.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.186 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.5 -2.83 37.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.378 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.53 144.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.829 0.347 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.434 HD23 ' N ' ' B' ' 86' ' ' LEU . 2.2 pt? -149.8 26.02 0.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.952 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -115.92 -16.13 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.276 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.556 ' O ' HD23 ' B' ' 92' ' ' LEU . 67.7 m-20 -70.99 -10.08 59.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.736 0.303 . . . . 0.0 111.261 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.742 ' O ' HD12 ' B' ' 93' ' ' LEU . 20.1 mm -89.63 -55.42 6.3 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.481 ' O ' ' HB ' ' B' ' 94' ' ' THR . 20.0 tt0 -66.13 -17.78 64.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.217 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . 0.794 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.92 -55.33 3.81 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.553 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.556 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.2 mm? -59.05 -23.44 62.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.742 HD12 ' O ' ' B' ' 89' ' ' ILE . 0.4 OUTLIER -91.48 -40.8 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.968 179.811 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.794 HG22 ' HA ' ' B' ' 91' ' ' ALA . 10.6 t -71.16 -11.7 61.08 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.138 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.73 -33.72 1.26 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.756 -0.735 . . . . 0.0 113.044 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.07 -2.8 33.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 117.002 0.401 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.411 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 17.6 p90 40.46 79.55 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.671 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.163 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.757 0.313 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.569 ' HB3' HG22 ' B' ' 57' ' ' VAL . 0.2 OUTLIER -145.49 76.61 1.48 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.096 -179.493 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.452 HD23 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -177.65 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 116.719 -0.218 . . . . 0.0 111.13 -179.623 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.47 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.2 m 24.8 -85.3 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.435 ' CB ' ' CD2' ' B' ' 53' ' ' HIS . 4.0 mm-40 -62.74 -68.03 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.893 0.378 . . . . 0.0 111.744 -178.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.562 HG22 ' HB3' ' B' ' 53' ' ' HIS . 1.9 t -55.94 -44.55 78.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.289 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.714 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.1 pt-20 -52.98 -48.19 67.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.452 0.644 . . . . 0.0 109.452 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.48 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 27.8 t -66.39 -20.16 65.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.636 178.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 2.2 tpm_? -70.01 -71.73 0.23 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.832 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.845 ' CD1' HD22 ' A' ' 64' ' ' LEU . 3.5 mm? -61.21 -38.77 87.77 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.245 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.559 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 8.0 tt0 -53.41 -39.44 64.32 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.795 176.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.1 OUTLIER -70.25 -28.54 65.32 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.845 HD22 ' CD1' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.35 68.92 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 68' ' ' PHE . 30.0 tt0 -88.63 -25.48 22.4 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.355 178.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.27 -76.73 0.06 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.924 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.36 42.09 1.87 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.422 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.563 ' CD2' HD21 ' B' ' 64' ' ' LEU . 31.7 p90 -39.46 104.84 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.988 0.423 . . . . 0.0 111.546 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.91 -66.69 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.789 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 71.3 mt -150.27 -79.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.989 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.92 24.65 4.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.378 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.96 91.02 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.011 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.25 108.51 2.0 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.531 2.154 . . . . 0.0 112.304 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.04 146.89 32.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 55.97 177.72 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.078 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -125.12 37.45 4.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.88 35.38 1.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.856 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.21 20.33 15.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.99 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.15 -28.69 66.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 110.679 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 26.9 mm -79.46 -45.72 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.862 ' HB2' HD23 ' B' ' 81' ' ' LEU . 0.5 OUTLIER -69.43 -24.65 63.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.191 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.27 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.913 0.387 . . . . 0.0 110.891 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 44.4 mtp -57.98 -25.39 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.258 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.03 -59.02 0.45 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.035 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 m 64.53 -163.42 0.26 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.801 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.503 HD23 HD12 ' B' ' 86' ' ' LEU . 1.9 mt 70.41 30.28 3.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.33 -53.07 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.699 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.5 m-20 -70.5 -11.43 60.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.919 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.63 ' O ' HD13 ' A' ' 93' ' ' LEU . 26.4 mm -90.3 -52.06 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.615 ' HA ' HD22 ' B' ' 93' ' ' LEU . 1.5 tt0 -66.02 -17.95 65.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.033 177.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.773 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.89 -53.6 4.67 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.583 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 6.1 mp -61.13 -21.22 63.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.054 0.454 . . . . 0.0 110.156 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.63 HD13 ' O ' ' A' ' 89' ' ' ILE . 7.5 mp -94.52 -38.45 10.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.862 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.773 HG22 ' HA ' ' A' ' 91' ' ' ALA . 12.3 t -72.28 -13.47 61.51 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.909 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.36 -32.32 1.06 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.146 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.472 ' O ' ' CG ' ' A' ' 97' ' ' PHE . 0.4 OUTLIER -115.67 5.59 14.31 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.518 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.472 ' CG ' ' O ' ' A' ' 96' ' ' LEU . 39.0 p90 46.22 -145.21 0.21 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.355 -179.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 12.4 p . . . . . 0 C--N 1.327 -0.391 0 CA-C-O 120.855 0.359 . . . . 0.0 111.166 -179.867 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.716 0.293 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.562 ' HB3' HG22 ' A' ' 57' ' ' VAL . 0.2 OUTLIER -145.32 76.71 1.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.989 -179.476 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.457 HD23 ' H ' ' B' ' 55' ' ' THR . 0.5 OUTLIER -177.72 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.151 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.476 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.3 m 24.93 -85.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.44 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 4.0 mm-40 -62.84 -67.97 0.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.873 0.368 . . . . 0.0 111.705 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 53' ' ' HIS . 1.9 t -55.9 -44.71 78.83 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.177 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.702 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.1 pt-20 -52.9 -48.23 67.36 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.429 0.633 . . . . 0.0 109.49 179.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.49 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 28.0 t -66.29 -20.24 66.05 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.61 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -69.97 -71.71 0.23 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.891 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.837 ' CD1' HD22 ' B' ' 64' ' ' LEU . 3.5 mm? -61.3 -38.7 87.75 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.427 -0.909 . . . . 0.0 109.169 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.551 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 8.0 tt0 -53.56 -39.32 64.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.765 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.1 OUTLIER -70.26 -28.59 65.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.837 HD22 ' CD1' ' B' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.43 68.97 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.449 ' HG2' ' HA ' ' B' ' 68' ' ' PHE . 29.6 tt0 -88.43 -25.65 22.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.45 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -76.83 0.06 Allowed 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.815 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.43 42.21 1.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.35 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.556 ' CD2' HD21 ' A' ' 64' ' ' LEU . 31.8 p90 -39.43 104.73 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.859 0.361 . . . . 0.0 111.593 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.744 HD23 ' HG ' ' B' ' 70' ' ' LEU . 8.0 tt -145.91 -66.32 0.3 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.891 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.744 ' HG ' HD23 ' B' ' 69' ' ' LEU . 71.7 mt -150.49 -79.43 0.12 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.88 24.6 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.316 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.98 90.96 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.007 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -69.36 108.57 2.03 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.358 2.039 . . . . 0.0 112.273 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.98 146.92 32.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.963 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -57.95 88.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 p30 -131.07 23.38 4.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.82 89.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.227 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -113.9 20.09 16.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.83 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.2 -28.74 66.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.657 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 26.6 mm -79.28 -45.94 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.858 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.862 HD23 ' HB2' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -69.26 -24.66 64.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.29 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.24 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 44.6 mtp -57.94 -25.47 60.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.226 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.05 -59.11 0.45 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.781 0.324 . . . . 0.0 111.019 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 m 64.68 -163.48 0.26 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.829 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.503 HD12 HD23 ' A' ' 86' ' ' LEU . 0.4 OUTLIER 70.34 30.21 3.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.08 -53.04 0.91 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.728 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.5 m-20 -70.56 -11.42 60.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.881 0.372 . . . . 0.0 110.934 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.635 ' O ' HD13 ' B' ' 93' ' ' LEU . 26.5 mm -90.3 -52.0 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.606 ' HA ' HD22 ' A' ' 93' ' ' LEU . 1.5 tt0 -66.02 -17.87 64.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.086 177.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . 0.81 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.92 -53.66 4.63 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.588 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 6.1 mp -61.02 -21.35 63.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.423 . . . . 0.0 110.0 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.635 HD13 ' O ' ' B' ' 89' ' ' ILE . 7.5 mp -94.62 -38.33 10.9 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.81 HG22 ' HA ' ' B' ' 91' ' ' ALA . 12.4 t -72.29 -13.43 61.5 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.889 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.32 -32.36 1.06 Allowed Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.151 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.478 ' O ' ' CG ' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -115.64 5.59 14.34 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.478 ' CG ' ' O ' ' B' ' 96' ' ' LEU . 39.0 p90 46.34 -145.28 0.22 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.327 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 120.814 0.34 . . . . 0.0 111.22 -179.978 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.871 0.367 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.451 ' CD2' ' NE2' ' B' ' 53' ' ' HIS . 3.1 t-160 -62.06 83.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.454 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.93 HD12 HG22 ' B' ' 57' ' ' VAL . 2.3 tp 179.79 -33.55 0.01 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.656 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.568 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 5.1 m -45.23 -80.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -35.02 -65.44 0.22 Allowed 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.944 HG22 HD12 ' B' ' 54' ' ' LEU . 4.3 t -52.86 -28.99 14.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.234 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.673 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.7 pt-20 -64.92 -48.75 73.02 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.424 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 53.1 p -64.54 -18.61 64.99 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.501 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -75.61 0.12 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.078 -179.709 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.846 HD13 HD22 ' A' ' 64' ' ' LEU . 3.6 mm? -59.97 -29.72 68.62 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.032 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.677 ' HB2' HD12 ' B' ' 61' ' ' LEU . 19.6 tt0 -62.89 -39.5 94.7 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.081 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.56 -15.55 58.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.754 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.846 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -85.64 -24.28 27.16 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.421 -179.547 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.511 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -104.46 -21.9 13.39 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.78 -179.573 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.595 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -84.43 2.01 42.71 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.264 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.46 HD23 ' CD2' ' A' ' 68' ' ' PHE . 6.0 tp -114.09 -35.13 5.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 110.916 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.46 ' CD2' HD23 ' A' ' 67' ' ' LEU . 46.9 m-85 -141.61 166.91 23.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.971 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.9 mt 58.95 55.73 4.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.053 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.595 HD11 ' HA ' ' A' ' 66' ' ' GLN . 10.0 mt -129.19 -85.36 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.56 17.38 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.605 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.82 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.886 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.83 118.0 5.21 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.402 2.068 . . . . 0.0 112.339 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -161.86 162.27 29.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.808 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -144.54 133.21 22.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.915 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -177.64 -46.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.887 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 64.32 126.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.055 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.18 46.48 7.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.017 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 27.8 mtp -70.07 -41.18 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.749 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.945 HG22 HD23 ' B' ' 81' ' ' LEU . 12.5 mm -63.5 -51.33 71.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.834 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 1.075 HD22 HD22 ' B' ' 81' ' ' LEU . 0.9 OUTLIER -66.14 -29.03 69.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.854 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.9 -30.0 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.992 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.3 -21.6 24.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.05 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.83 102.72 15.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.901 0.382 . . . . 0.0 110.78 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.59 87.03 1.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.698 ' HB3' HD23 ' B' ' 86' ' ' LEU . 0.4 OUTLIER -114.48 -17.98 11.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -71.4 -8.89 56.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.526 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 68.3 m-20 -73.1 -9.85 59.17 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.798 0.333 . . . . 0.0 110.995 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.554 HG22 HG22 ' B' ' 89' ' ' ILE . 7.4 mm -88.6 -53.0 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 94' ' ' THR . 1.6 tt0 -67.02 -20.7 65.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.911 178.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.25 -67.43 0.8 Allowed 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.409 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.534 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.1 tt -52.05 -23.74 5.69 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.02 0.438 . . . . 0.0 110.389 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.903 HD12 HD12 ' B' ' 93' ' ' LEU . 8.1 tt -87.77 -38.43 15.77 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.532 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.405 ' CB ' ' O ' ' A' ' 90' ' ' GLU . 3.8 m -72.76 -10.89 60.32 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.87 -30.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.477 -0.868 . . . . 0.0 113.788 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.06 4.88 3.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 93' ' ' LEU . 22.7 p90 40.3 70.57 0.23 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.575 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.844 ' HB ' HD11 ' B' ' 93' ' ' LEU . 13.8 p . . . . . 0 C--O 1.233 0.212 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.863 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.88 0.371 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.451 ' NE2' ' CD2' ' A' ' 53' ' ' HIS . 3.2 t-160 -62.04 83.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.53 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.944 HD12 HG22 ' A' ' 57' ' ' VAL . 2.3 tp 179.84 -33.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.755 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.569 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 5.0 m -45.15 -80.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -34.91 -65.53 0.21 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.93 HG22 HD12 ' A' ' 54' ' ' LEU . 4.3 t -52.88 -28.94 14.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.165 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.656 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.7 pt-20 -64.98 -48.62 73.34 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 53.0 p -64.67 -18.55 65.08 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.512 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -75.54 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.067 -179.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.854 HD13 HD22 ' B' ' 64' ' ' LEU . 3.6 mm? -60.02 -29.71 68.68 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.948 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.658 ' HB2' HD12 ' A' ' 61' ' ' LEU . 19.6 tt0 -62.79 -39.67 94.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.132 177.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.54 -15.48 58.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.716 178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.854 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -85.68 -24.4 27.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.906 0.384 . . . . 0.0 111.339 -179.591 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.517 ' O ' HD11 ' B' ' 70' ' ' LEU . 0.1 OUTLIER -104.47 -21.83 13.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 0.611 ' HA ' HD11 ' B' ' 70' ' ' LEU . 0.0 OUTLIER -84.53 2.2 42.27 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.298 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.465 HD23 ' CD2' ' B' ' 68' ' ' PHE . 6.0 tp -114.07 -35.18 5.14 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.833 0.349 . . . . 0.0 110.95 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.465 ' CD2' HD23 ' B' ' 67' ' ' LEU . 46.7 m-85 -141.58 166.9 23.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.035 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 mp 58.95 55.56 4.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.093 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.611 HD11 ' HA ' ' B' ' 66' ' ' GLN . 10.0 mt -128.98 -85.41 0.56 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.817 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.57 17.5 4.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.586 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.93 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.726 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.85 117.87 5.11 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.508 2.139 . . . . 0.0 112.349 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -161.31 160.39 29.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.826 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -119.44 -165.17 1.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.922 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.59 101.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.77 164.15 18.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.77 46.49 8.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.816 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 27.9 mtp -69.92 -41.28 74.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.719 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.903 HG22 HD23 ' A' ' 81' ' ' LEU . 12.4 mm -63.44 -51.35 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 1.075 HD22 HD22 ' A' ' 81' ' ' LEU . 0.9 OUTLIER -66.17 -28.95 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.873 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.85 -30.18 62.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.972 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.24 -21.59 24.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.064 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.78 102.8 15.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.865 0.364 . . . . 0.0 110.744 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.69 87.12 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.01 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.698 HD23 ' HB3' ' A' ' 86' ' ' LEU . 1.9 mp -114.41 -18.19 11.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.269 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -71.36 -8.82 56.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.523 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 68.4 m-20 -73.02 -9.97 59.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.803 0.335 . . . . 0.0 111.04 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.554 HG22 HG22 ' A' ' 89' ' ' ILE . 7.4 mm -88.64 -53.03 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.401 ' O ' ' CB ' ' B' ' 94' ' ' THR . 1.6 tt0 -66.96 -20.71 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.947 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.18 -67.44 0.79 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.529 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.537 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.1 tt -51.96 -23.91 5.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.979 0.419 . . . . 0.0 110.309 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.903 HD12 HD12 ' A' ' 93' ' ' LEU . 8.1 tt -87.72 -38.38 15.86 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.554 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.401 ' CB ' ' O ' ' B' ' 90' ' ' GLU . 3.8 m -72.73 -10.91 60.35 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.155 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.92 -30.23 1.66 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.433 -0.889 . . . . 0.0 113.645 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.09 4.97 3.01 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' B' ' 93' ' ' LEU . 22.8 p90 40.26 70.48 0.24 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.878 0.37 . . . . 0.0 111.618 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . 0.851 ' HB ' HD11 ' A' ' 93' ' ' LEU . 13.7 p . . . . . 0 CA--C 1.53 0.193 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.81 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.828 0.347 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 179.05 57.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.634 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.665 ' CD2' HG13 ' B' ' 57' ' ' VAL . 0.3 OUTLIER -136.35 -51.49 0.7 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.873 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 54' ' ' LEU . 92.3 m 15.2 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.477 ' N ' ' O ' ' A' ' 54' ' ' LEU . 8.4 pt-20 -64.96 -55.95 16.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.632 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.739 ' HB ' HG11 ' B' ' 57' ' ' VAL . 4.6 t -59.6 -50.0 81.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-O 120.524 0.202 . . . . 0.0 111.454 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.782 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -53.11 -49.67 66.03 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.5 t -61.65 -21.43 64.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.589 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.454 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 0.7 OUTLIER -71.26 -73.17 0.19 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.311 -179.337 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.773 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -60.85 -27.1 67.85 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.129 -178.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.473 ' HB2' HD12 ' B' ' 61' ' ' LEU . 1.8 tt0 -66.83 -38.81 87.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.376 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.762 ' HG2' HD21 ' A' ' 67' ' ' LEU . 45.2 ttp180 -83.54 -9.18 59.11 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.78 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.953 HD22 ' O ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -91.83 -27.41 17.98 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.03 0.443 . . . . 0.0 111.254 -179.079 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.841 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 1.4 tp10 -113.5 -48.3 2.95 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 8.4 tt0 -47.0 -43.82 19.71 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.762 HD21 ' HG2' ' A' ' 63' ' ' ARG . 3.3 pp -97.49 22.7 8.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.775 0.321 . . . . 0.0 111.038 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -135.65 96.3 3.42 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 110.649 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.998 HD21 HD23 ' B' ' 69' ' ' LEU . 0.2 OUTLIER -154.97 158.7 39.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.619 -179.649 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.752 ' H ' HD13 ' A' ' 69' ' ' LEU . 31.3 mt -49.74 -28.18 5.8 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.826 0.345 . . . . 0.0 111.064 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 34.1 mm -67.32 -14.33 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.275 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.21 106.12 0.59 Allowed Pre-proline 0 C--N 1.332 -0.183 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.8 127.0 13.93 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.403 2.069 . . . . 0.0 112.336 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.27 -40.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.864 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -131.49 177.28 7.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -110.78 75.91 0.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.014 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.25 -39.66 62.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.77 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.537 ' CB ' HD21 ' A' ' 81' ' ' LEU . 50.4 m-20 -146.69 93.77 2.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.868 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.16 -24.48 64.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.081 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.0 mm -63.31 -56.3 18.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.365 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.537 HD21 ' CB ' ' A' ' 78' ' ' ASP . 0.4 OUTLIER -82.89 -10.45 58.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.599 -179.657 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -88.19 -27.3 21.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.55 0.214 . . . . 0.0 111.263 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -16.25 12.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.536 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.57 -66.3 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.795 0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.59 -171.32 0.19 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.187 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -168.08 -43.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.786 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.876 ' CB ' ' HB2' ' A' ' 91' ' ' ALA . 38.1 mtt180 -107.89 -67.94 0.93 Allowed 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.826 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.6 m-20 21.53 -59.39 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.873 ' N ' ' O ' ' A' ' 87' ' ' ARG . 19.9 mm -84.27 -58.24 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 94' ' ' THR . 3.4 tm-20 -66.13 -12.06 53.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.347 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.876 ' HB2' ' CB ' ' A' ' 87' ' ' ARG . . . -87.22 -57.09 3.09 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.172 0.511 . . . . 0.0 110.054 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 0.1 OUTLIER -60.26 -21.28 61.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.869 178.884 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.676 HD23 ' O ' ' A' ' 97' ' ' PHE . 5.1 mt -93.34 -35.43 13.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.736 HG22 ' HA ' ' A' ' 91' ' ' ALA . 12.8 t -75.61 -12.26 60.18 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.66 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.03 -29.44 1.81 Allowed Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.206 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.61 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -118.88 2.17 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.441 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.676 ' O ' HD23 ' A' ' 93' ' ' LEU . 0.1 OUTLIER 37.67 -93.1 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.167 179.638 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.457 ' O ' HD23 ' A' ' 96' ' ' LEU . 20.1 t . . . . . 0 C--N 1.33 -0.269 0 CA-C-O 120.779 0.323 . . . . 0.0 111.238 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.812 0.339 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 179.02 57.45 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.683 ' CD2' HG13 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -136.24 -51.47 0.71 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.9 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.449 ' C ' ' O ' ' B' ' 54' ' ' LEU . 92.2 m 15.16 -79.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' B' ' 54' ' ' LEU . 8.4 pt-20 -65.06 -55.85 16.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.601 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.739 HG11 ' HB ' ' A' ' 57' ' ' VAL . 4.5 t -59.59 -50.0 81.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-O 120.538 0.208 . . . . 0.0 111.461 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.773 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -53.06 -49.68 65.87 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.347 0.594 . . . . 0.0 109.522 179.073 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 12.4 t -61.8 -21.34 64.51 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.511 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.442 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 0.7 OUTLIER -71.38 -73.2 0.19 Allowed 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.417 -0.811 . . . . 0.0 112.267 -179.301 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.782 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -60.84 -26.91 67.69 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.207 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' B' ' 66' ' ' GLN . 1.8 tt0 -66.89 -38.82 86.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.317 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . 0.782 ' HG2' HD21 ' B' ' 67' ' ' LEU . 45.0 ttp180 -83.43 -9.35 59.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.808 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.972 ' O ' HD22 ' B' ' 64' ' ' LEU . 0.0 OUTLIER -91.82 -27.42 17.99 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.01 0.433 . . . . 0.0 111.271 -179.032 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.841 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.4 tp10 -113.53 -48.24 2.95 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' B' ' 62' ' ' GLU . 8.4 tt0 -46.99 -43.69 19.55 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.782 HD21 ' HG2' ' B' ' 63' ' ' ARG . 3.3 pp -97.56 22.71 8.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.724 0.297 . . . . 0.0 111.003 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -135.6 97.15 3.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.861 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.998 HD23 HD21 ' A' ' 69' ' ' LEU . 0.3 OUTLIER -156.12 160.93 40.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.814 179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 31.9 mt -51.12 -28.46 10.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.695 ' HB ' HD13 ' B' ' 69' ' ' LEU . 33.9 mm -67.34 -14.17 17.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.391 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.18 106.02 0.57 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.236 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.66 127.05 14.11 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.41 2.074 . . . . 0.0 112.387 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.16 -39.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.855 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.99 -176.32 3.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -78.52 -69.92 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.94 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.6 mt 68.82 -68.1 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . 0.541 ' CB ' HD21 ' B' ' 81' ' ' LEU . 50.3 m-20 -147.19 94.05 2.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.25 -24.51 64.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.09 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 39.3 mm -63.38 -56.17 18.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.315 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.541 HD21 ' CB ' ' B' ' 78' ' ' ASP . 0.4 OUTLIER -82.97 -10.5 58.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.689 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -88.07 -27.33 22.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.685 0.279 . . . . 0.0 111.404 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.51 -16.18 12.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.621 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.5 -66.36 0.29 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.777 0.322 . . . . 0.0 111.012 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.7 -171.26 0.19 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.974 0.416 . . . . 0.0 111.026 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -168.15 -43.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.763 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.877 ' CB ' ' HB2' ' B' ' 91' ' ' ALA . 38.7 mtt180 -108.23 -67.9 0.94 Allowed 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.769 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.6 m-20 21.71 -59.54 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.872 ' N ' ' O ' ' B' ' 87' ' ' ARG . 20.4 mm -84.33 -58.22 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.507 ' O ' ' HB ' ' B' ' 94' ' ' THR . 3.4 tm-20 -66.0 -12.19 53.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.392 177.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . 0.877 ' HB2' ' CB ' ' B' ' 87' ' ' ARG . . . -87.15 -57.03 3.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.138 0.494 . . . . 0.0 110.084 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.422 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 0.1 OUTLIER -60.15 -21.29 61.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.985 178.78 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.675 HD23 ' O ' ' B' ' 97' ' ' PHE . 5.1 mt -93.32 -35.52 13.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.929 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.713 HG22 ' HA ' ' B' ' 91' ' ' ALA . 12.6 t -75.53 -12.26 60.19 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.752 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.04 -29.55 1.78 Allowed Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.722 -0.752 . . . . 0.0 113.137 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.62 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.6 OUTLIER -118.78 2.16 11.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.492 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.675 ' O ' HD23 ' B' ' 93' ' ' LEU . 0.1 OUTLIER 37.78 -93.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.022 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . 0.461 ' O ' HD23 ' B' ' 96' ' ' LEU . 20.0 t . . . . . 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 0.0 111.27 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.584 0.23 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 59.76 111.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.875 0.369 . . . . 0.0 110.889 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.964 HD23 HG22 ' B' ' 57' ' ' VAL . 1.3 mt -119.15 -17.15 9.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.811 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.521 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 92.7 m -53.6 -84.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.29 -60.93 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.951 HG22 HD23 ' B' ' 54' ' ' LEU . 3.3 t -56.73 -39.33 63.06 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 120.918 0.389 . . . . 0.0 111.842 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.81 ' O ' HD13 ' B' ' 61' ' ' LEU . 1.3 pt-20 -58.52 -55.06 39.96 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.478 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 31.4 t -63.53 -14.91 55.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.623 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.523 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 1.7 ttt180 -70.83 -74.03 0.16 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.493 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 1.11 HD23 HD22 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -66.17 -20.02 66.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 117.772 -1.571 . . . . 0.0 109.702 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.943 ' CB ' HD22 ' B' ' 61' ' ' LEU . 11.0 tm-20 -64.4 -38.5 91.25 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 175.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -70.91 -29.35 65.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.863 177.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 1.11 HD22 HD23 ' A' ' 61' ' ' LEU . 0.1 OUTLIER -67.47 -28.39 67.82 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.804 178.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -83.71 -31.28 26.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.249 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -29.08 68.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.28 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' A' ' 68' ' ' PHE . 7.3 mt -84.06 -12.18 55.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.019 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.464 ' CE1' ' CG2' ' A' ' 71' ' ' ILE . 83.8 t80 65.54 95.22 0.06 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.873 0.368 . . . . 0.0 110.775 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.497 HD13 ' H ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -155.22 157.42 37.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.967 -179.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.497 ' H ' HD13 ' A' ' 69' ' ' LEU . 1.0 OUTLIER 54.08 21.65 3.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.68 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.614 HD13 ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -120.96 -48.61 2.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.672 0.273 . . . . 0.0 110.827 179.715 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.496 ' N ' HG23 ' A' ' 71' ' ' ILE . 4.6 m-85 55.84 165.57 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.861 0.363 . . . . 0.0 111.262 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -78.19 126.07 7.53 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.642 2.228 . . . . 0.0 112.263 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.06 -30.58 11.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.993 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -91.98 166.71 12.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.949 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.466 ' OD1' HG23 ' B' ' 80' ' ' ILE . 19.0 t70 -107.82 -43.12 4.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 mp 63.49 140.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.574 ' HA ' HD21 ' A' ' 81' ' ' LEU . 1.5 t0 -109.84 -26.29 9.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.46 -29.1 61.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.073 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -65.14 -66.47 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.881 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.824 ' O ' HD13 ' A' ' 86' ' ' LEU . 0.6 OUTLIER -60.22 -19.35 54.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 179.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -81.23 -31.53 33.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.802 0.334 . . . . 0.0 111.027 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.4 ptm -92.6 -13.44 29.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.573 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.18 51.73 2.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 111.423 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.0 m 44.92 93.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.573 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.824 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -115.9 -28.67 6.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.166 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.34 -11.5 59.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.494 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.547 ' O ' HD12 ' A' ' 92' ' ' LEU . 3.2 m-20 -71.48 -10.43 59.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.718 0.294 . . . . 0.0 111.295 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.8 mm -89.58 -55.52 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.42 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.545 ' HG3' HD11 ' B' ' 93' ' ' LEU . 38.1 tt0 -66.32 -17.91 65.04 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.303 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.83 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -88.24 -53.42 4.71 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.453 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.547 HD12 ' O ' ' A' ' 88' ' ' ASP . 16.8 mt -58.76 -25.22 62.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.973 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.548 HD11 ' HG3' ' B' ' 90' ' ' GLU . 0.8 OUTLIER -91.99 -39.38 11.7 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.067 179.845 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.83 HG22 ' HA ' ' A' ' 91' ' ' ALA . 10.7 t -70.94 -11.78 61.16 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.008 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.76 -34.76 1.23 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.958 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.402 ' C ' ' CD1' ' A' ' 97' ' ' PHE . 0.1 OUTLIER -98.36 -2.27 39.68 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.945 0.372 . . . . 0.0 111.914 -179.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.402 ' CD1' ' C ' ' A' ' 96' ' ' LEU . 3.4 p90 40.5 -125.94 0.45 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.277 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.332 -0.159 0 CA-C-O 120.803 0.335 . . . . 0.0 111.229 -179.928 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.706 0.289 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 59.93 111.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.867 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.951 HD23 HG22 ' A' ' 57' ' ' VAL . 1.3 mt -119.21 -17.29 8.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.796 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.524 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 92.5 m -53.53 -84.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.32 -60.97 0.17 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.964 HG22 HD23 ' A' ' 54' ' ' LEU . 3.2 t -56.62 -39.33 62.16 Favored 'Isoleucine or valine' 0 C--O 1.25 1.08 0 CA-C-O 120.939 0.399 . . . . 0.0 111.93 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.809 ' O ' HD13 ' A' ' 61' ' ' LEU . 1.2 pt-20 -58.58 -55.06 39.89 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.485 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 31.2 t -63.49 -15.01 56.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.618 177.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.517 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 1.7 ttt180 -70.62 -74.19 0.15 Allowed 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.495 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 1.046 HD23 HD22 ' B' ' 64' ' ' LEU . 0.1 OUTLIER -66.15 -19.97 66.0 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 117.703 -1.599 . . . . 0.0 109.651 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.969 ' HB2' HD22 ' A' ' 61' ' ' LEU . 11.1 tm-20 -64.45 -38.5 91.23 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -70.92 -29.21 65.19 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.909 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 1.046 HD22 HD23 ' B' ' 61' ' ' LEU . 0.1 OUTLIER -67.54 -28.46 67.83 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.697 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -83.71 -31.35 26.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.093 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -29.09 68.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.262 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' B' ' 68' ' ' PHE . 7.3 mt -83.95 -12.18 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.657 ' O ' HD22 ' B' ' 69' ' ' LEU . 83.7 t80 65.58 95.14 0.06 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.801 0.334 . . . . 0.0 110.713 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.657 HD22 ' O ' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -155.25 157.32 37.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 54.15 21.78 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.588 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.609 HD13 ' O ' ' B' ' 71' ' ' ILE . 0.0 OUTLIER -120.97 -48.64 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.611 0.243 . . . . 0.0 110.839 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . 0.49 ' N ' HG23 ' B' ' 71' ' ' ILE . 4.6 m-85 55.77 165.66 0.06 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.277 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.34 126.16 7.47 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.541 2.161 . . . . 0.0 112.268 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.05 -30.63 11.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.997 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -92.1 167.24 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -108.26 -42.96 4.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.926 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.2 mt 63.52 140.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.985 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . 0.574 ' HA ' HD21 ' B' ' 81' ' ' LEU . 1.5 t0 -109.89 -26.28 9.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -29.21 61.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.016 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.466 HG23 ' OD1' ' A' ' 76' ' ' ASP . 35.6 mm -64.98 -66.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.973 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.574 HD21 ' HA ' ' B' ' 78' ' ' ASP . 0.6 OUTLIER -60.3 -19.39 54.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.135 179.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -80.96 -31.69 34.77 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.823 0.344 . . . . 0.0 111.121 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 25.5 ptm -92.63 -13.38 29.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.568 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.25 51.75 2.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.781 0.324 . . . . 0.0 111.39 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 6.1 m 45.01 93.05 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.484 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tp -115.82 -28.79 6.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.044 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.36 -11.41 59.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.548 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.548 ' O ' HD12 ' B' ' 92' ' ' LEU . 3.1 m-20 -71.51 -10.43 59.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 0.0 111.309 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 17.2 mm -89.66 -55.59 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.454 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.548 ' HG3' HD11 ' A' ' 93' ' ' LEU . 38.2 tt0 -66.11 -18.05 65.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.278 177.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . 0.814 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -88.23 -53.39 4.72 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.507 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.548 HD12 ' O ' ' B' ' 88' ' ' ASP . 16.8 mt -58.77 -25.19 62.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.076 0.465 . . . . 0.0 110.083 178.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.545 HD11 ' HG3' ' A' ' 90' ' ' GLU . 0.8 OUTLIER -91.93 -39.45 11.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.117 179.778 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.814 HG22 ' HA ' ' B' ' 91' ' ' ALA . 10.8 t -70.91 -11.88 61.22 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.942 179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.67 -34.73 1.24 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.002 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.406 ' C ' ' CD1' ' B' ' 97' ' ' PHE . 0.1 OUTLIER -98.44 -2.09 39.85 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.758 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' B' ' 96' ' ' LEU . 3.4 p90 40.54 -125.93 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.304 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p . . . . . 0 C--N 1.332 -0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.998 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.445 ' O ' ' CG ' ' A' ' 53' ' ' HIS . . . . . . . . 0 CA--C 1.533 0.321 0 N-CA-C 110.905 -0.035 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 52' ' ' ALA . 21.2 p80 43.58 30.06 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.753 0.311 . . . . 0.0 111.456 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.67 -32.59 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 1.7 m -75.59 -41.25 55.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.441 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.8 -40.97 63.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.928 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.578 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 2.8 t -71.89 -40.94 69.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 120.975 0.417 . . . . 0.0 110.839 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.774 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 24.5 pt-20 -62.63 -48.15 80.64 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.434 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 3.5 m -63.42 -22.67 67.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.309 177.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 2.7 mtt-85 -68.54 -71.68 0.21 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.671 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.0 mm? -61.37 -24.79 66.73 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.844 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.493 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.05 -37.02 86.21 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.69 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -31.13 68.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.866 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.518 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -68.48 -27.77 66.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.293 178.369 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.47 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 2.2 tm-20 -80.88 -31.58 35.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.473 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.02 -49.47 65.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.76 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.659 HD12 ' O ' ' A' ' 68' ' ' PHE . 3.7 pp -63.0 -26.98 69.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.916 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.659 ' O ' HD12 ' A' ' 67' ' ' LEU . 2.1 m-85 64.68 160.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.934 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.94 88.22 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.795 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 51.57 51.67 16.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 1.044 HD11 HD11 ' B' ' 71' ' ' ILE . 0.5 OUTLIER 41.82 31.35 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.897 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.435 ' HB2' ' CZ ' ' B' ' 68' ' ' PHE . 10.9 t80 68.31 100.96 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.62 -174.87 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.684 2.256 . . . . 0.0 112.169 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 66.5 -73.88 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.9 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 66.79 6.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.653 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.64 -46.28 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.028 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 tp 60.78 159.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.722 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.649 ' HA ' HD21 ' A' ' 81' ' ' LEU . 5.7 p-10 -136.06 19.81 3.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.168 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -35.4 63.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.833 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.859 HG12 HD13 ' B' ' 71' ' ' ILE . 3.2 mp -64.01 -46.02 95.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' A' ' 78' ' ' ASP . 0.3 OUTLIER -77.08 -27.88 54.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.895 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -27.84 62.55 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.81 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . 0.409 ' HE3' ' HA ' ' A' ' 80' ' ' ILE . 13.5 ptp -95.64 -25.04 16.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.094 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.59 -50.45 9.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.693 ' OG ' HD21 ' B' ' 86' ' ' LEU . 13.7 p -178.93 130.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.977 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -175.89 -57.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.807 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -80.11 -28.45 38.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.789 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -72.75 -9.41 58.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.849 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.448 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 17.4 mm -89.66 -54.74 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -64.51 -21.11 66.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.197 177.799 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.752 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -86.42 -67.34 0.82 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.717 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 96' ' ' LEU . 71.6 mt -49.01 -26.61 2.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.063 0.459 . . . . 0.0 110.413 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.829 HD12 HD12 ' B' ' 93' ' ' LEU . 1.0 OUTLIER -87.87 -44.01 11.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.978 179.672 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.752 HG22 ' HA ' ' A' ' 91' ' ' ALA . 9.8 t -67.79 -8.27 34.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.583 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.71 -29.73 1.65 Allowed Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.022 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.2 OUTLIER -100.43 -1.65 35.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.864 0.364 . . . . 0.0 111.96 -179.609 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.663 ' O ' HG12 ' A' ' 98' ' ' VAL . 73.9 t80 -65.85 -57.4 8.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.625 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 97' ' ' PHE . 9.9 p . . . . . 0 CA--C 1.53 0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.139 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' B' ' 53' ' ' HIS . . . . . . . . 0 CA--C 1.533 0.319 0 N-CA-C 110.953 -0.017 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.437 ' CG ' ' O ' ' B' ' 52' ' ' ALA . 21.3 p80 43.65 29.98 0.32 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.825 0.345 . . . . 0.0 111.535 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.65 -32.6 0.69 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.425 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 1.8 m -75.66 -41.23 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.75 -41.01 63.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.922 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.577 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 2.8 t -71.92 -40.83 68.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.083 0.468 . . . . 0.0 110.888 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.762 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.5 pt-20 -62.8 -47.98 81.11 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.433 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 3.5 m -63.52 -22.61 66.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.347 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.577 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 2.7 mtt-85 -68.47 -71.65 0.21 Allowed 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.791 -179.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.0 mm? -61.27 -24.91 66.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 119.173 -1.011 . . . . 0.0 109.858 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.49 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -64.96 -37.2 86.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.713 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -31.13 69.03 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.033 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.532 ' HA ' HD21 ' B' ' 67' ' ' LEU . 0.3 OUTLIER -68.37 -27.81 66.57 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.349 178.29 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.47 ' HB2' ' HB2' ' A' ' 65' ' ' GLU . 2.2 tm-20 -80.97 -31.48 34.78 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.414 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -49.58 64.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.795 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.662 HD12 ' O ' ' B' ' 68' ' ' PHE . 3.7 pp -62.89 -27.0 69.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.939 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.662 ' O ' HD12 ' B' ' 67' ' ' LEU . 2.1 m-85 64.64 160.53 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.634 ' O ' HD23 ' B' ' 69' ' ' LEU . 10.2 tt -143.75 88.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.792 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 51.39 51.72 16.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.076 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 1.044 HD11 HD11 ' A' ' 71' ' ' ILE . 0.5 OUTLIER 41.83 31.34 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.869 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 68' ' ' PHE . 10.9 t80 68.32 100.78 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.062 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.45 -174.76 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.638 2.226 . . . . 0.0 112.236 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 66.36 -74.37 0.06 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.051 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.82 -69.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.944 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -66.86 0.24 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp 60.03 166.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.952 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . 0.637 ' HA ' HD21 ' B' ' 81' ' ' LEU . 5.6 p-10 -136.15 19.87 3.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.088 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -35.42 63.24 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.864 0.364 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.855 HG12 HD13 ' A' ' 71' ' ' ILE . 3.2 mp -64.06 -45.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.907 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.637 HD21 ' HA ' ' B' ' 78' ' ' ASP . 0.3 OUTLIER -77.26 -27.89 53.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.777 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -27.79 62.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.814 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 13.5 ptp -95.64 -25.07 16.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.023 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.57 -50.42 10.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.974 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 13.7 p -178.91 130.12 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.828 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.693 HD21 ' OG ' ' A' ' 85' ' ' SER . 0.2 OUTLIER -175.91 -57.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.827 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -80.25 -28.43 38.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.758 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.65 -9.45 58.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.843 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.443 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 17.0 mm -89.56 -54.75 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 94' ' ' THR . 0.0 OUTLIER -64.48 -21.18 66.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.191 177.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . 0.754 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -86.48 -67.22 0.83 Allowed 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.733 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.424 ' O ' ' HB2' ' B' ' 96' ' ' LEU . 71.5 mt -49.06 -26.65 2.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.13 0.491 . . . . 0.0 110.399 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.829 HD12 HD12 ' A' ' 93' ' ' LEU . 1.0 OUTLIER -87.77 -44.15 11.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.007 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.754 HG22 ' HA ' ' B' ' 91' ' ' ALA . 9.7 t -67.75 -8.2 33.62 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.549 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.72 -29.74 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.62 -0.8 . . . . 0.0 113.062 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.432 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -100.45 -1.65 35.27 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.963 0.381 . . . . 0.0 111.936 -179.663 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.678 ' O ' HG12 ' B' ' 98' ' ' VAL . 74.4 t80 -65.82 -57.38 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.681 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . 0.678 HG12 ' O ' ' B' ' 97' ' ' PHE . 10.0 p . . . . . 0 CA--C 1.53 0.191 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.151 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.901 0.381 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.7 p-80 -134.24 147.25 50.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.828 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.619 HD23 HG22 ' B' ' 57' ' ' VAL . 0.5 OUTLIER -136.31 -53.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.575 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.1 m 21.5 -86.31 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -68.31 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.974 0.416 . . . . 0.0 111.324 -179.251 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.615 ' HA ' ' HB2' ' A' ' 60' ' ' ARG . 22.6 t -53.82 -27.97 16.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.726 -179.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.718 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -66.55 -46.8 74.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.189 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.406 ' N ' ' HG2' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -68.02 -17.33 64.38 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.381 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.615 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -73.72 0.17 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.663 -179.805 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.826 HD13 HD22 ' A' ' 64' ' ' LEU . 4.1 mm? -62.35 -32.35 73.12 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.69 -179.364 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.687 ' HB2' HD12 ' B' ' 61' ' ' LEU . 3.4 tt0 -61.29 -36.31 79.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.199 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -81.09 -16.1 54.09 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.989 0.423 . . . . 0.0 110.023 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.983 HD23 ' HG2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -79.12 -27.19 42.83 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.376 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.983 ' HG2' HD23 ' A' ' 64' ' ' LEU . 7.6 mm-40 -102.86 -21.6 13.99 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.125 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.61 -36.07 83.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.962 0.411 . . . . 0.0 110.171 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 69' ' ' LEU . 0.2 OUTLIER -83.27 -0.35 49.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.742 179.384 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 73.1 m-85 67.4 -96.65 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.067 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 67' ' ' LEU . 0.4 OUTLIER 47.21 28.0 0.92 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.696 0.284 . . . . 0.0 111.155 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.8 mt -154.7 -45.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.161 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.824 HD13 ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.43 46.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.093 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . 0.48 ' CG ' ' O ' ' A' ' 72' ' ' PHE . 10.6 p90 -123.28 74.42 50.76 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.939 0.4 . . . . 0.0 110.866 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.54 16.62 1.88 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.818 2.345 . . . . 0.0 112.867 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.626 HH11 HD21 ' A' ' 77' ' ' LEU . 0.3 OUTLIER -86.64 -58.32 2.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.839 0.352 . . . . 0.0 111.028 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 59.0 27.79 16.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -153.67 -53.09 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.793 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.626 HD21 HH11 ' A' ' 74' ' ' ARG . 4.6 pp -120.39 -173.45 2.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.808 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.755 ' CG ' HD23 ' A' ' 81' ' ' LEU . 3.0 m-20 -137.49 93.96 2.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.763 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.5 -38.88 88.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.881 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 1.063 HG22 HD11 ' B' ' 81' ' ' LEU . 42.5 mm -73.51 -43.26 55.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 1.077 HD11 HG22 ' B' ' 80' ' ' ILE . 1.7 mm? -74.18 -22.29 59.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.252 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.912 ' HA ' HD22 ' A' ' 86' ' ' LEU . 2.6 mttt -90.35 -27.71 19.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.872 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.84 -23.91 25.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.062 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.589 ' HB2' HD12 ' B' ' 81' ' ' LEU . 12.8 m-20 -103.92 104.15 14.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.04 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.477 ' HB3' HD21 ' B' ' 86' ' ' LEU . 58.3 m 60.85 113.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.972 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.912 HD22 ' HA ' ' A' ' 82' ' ' LYS . 6.4 tp -178.45 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.027 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.69 -25.04 17.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.046 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.757 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.0 OUTLIER -70.24 -10.16 58.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.301 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.549 HG21 ' HB ' ' B' ' 89' ' ' ILE . 17.1 mm -90.73 -56.79 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.593 ' O ' ' HB ' ' A' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.22 64.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.22 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.696 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -86.96 -56.11 3.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.252 179.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.757 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.1 mm? -51.74 -26.27 9.14 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.891 HD13 ' HB3' ' B' ' 93' ' ' LEU . 0.3 OUTLIER -90.46 -38.51 13.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.696 HG22 ' HA ' ' A' ' 91' ' ' ALA . 2.1 t -67.33 -11.22 57.07 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.1 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.25 -28.6 1.62 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.486 -0.864 . . . . 0.0 113.052 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.448 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -102.93 2.4 35.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.543 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 29.3 p90 -41.05 137.64 1.24 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.556 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.2 p . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.096 179.939 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.944 0.402 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -134.39 147.11 50.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.602 HD23 HG22 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -136.28 -52.83 0.73 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.671 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 97.3 m 21.28 -86.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 179.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.29 -68.24 0.3 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.889 0.376 . . . . 0.0 111.312 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.622 ' HA ' ' HB2' ' B' ' 60' ' ' ARG . 23.1 t -53.86 -28.01 16.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.687 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.7 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -66.42 -46.84 75.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.135 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.408 ' N ' ' HG2' ' B' ' 58' ' ' GLU . 0.3 OUTLIER -67.92 -17.42 64.45 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.394 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.622 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -73.75 0.17 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.737 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.832 ' CD1' HD22 ' B' ' 64' ' ' LEU . 4.1 mm? -62.17 -32.36 72.97 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.49 -0.884 . . . . 0.0 109.851 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.67 ' HB2' HD12 ' A' ' 61' ' ' LEU . 3.5 tt0 -61.39 -36.23 79.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.249 177.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -81.08 -16.12 54.05 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.047 0.451 . . . . 0.0 110.014 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 1.053 HD23 ' HG2' ' B' ' 65' ' ' GLU . 0.0 OUTLIER -79.17 -27.12 42.64 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.336 179.941 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 1.053 ' HG2' HD23 ' B' ' 64' ' ' LEU . 7.6 mm-40 -102.84 -21.66 13.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.109 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.63 -36.16 83.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.944 0.402 . . . . 0.0 110.065 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -83.04 -0.45 49.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.799 179.307 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' B' ' 67' ' ' LEU . 72.9 m-85 67.41 -96.42 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.107 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.589 ' O ' HD23 ' B' ' 69' ' ' LEU . 1.6 tt 47.06 27.98 0.84 Allowed 'General case' 0 CA--C 1.528 0.103 0 CA-C-O 120.71 0.291 . . . . 0.0 111.272 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 98.1 mt -154.81 -45.8 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.152 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.846 HD13 ' O ' ' B' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.083 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . 0.473 ' O ' ' CG ' ' B' ' 72' ' ' PHE . 10.6 p90 -123.25 74.46 50.56 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-O 120.963 0.411 . . . . 0.0 110.851 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -87.53 16.54 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.905 2.403 . . . . 0.0 112.898 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.68 -58.15 2.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.841 0.353 . . . . 0.0 110.941 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.07 29.91 19.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 -158.4 -50.61 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.776 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -120.15 -177.82 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.822 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . 0.741 ' CG ' HD23 ' B' ' 81' ' ' LEU . 3.0 m-20 -135.61 93.28 2.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.631 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.37 -38.86 88.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.928 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 1.077 HG22 HD11 ' A' ' 81' ' ' LEU . 42.5 mm -73.56 -43.2 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 1.063 HD11 HG22 ' A' ' 80' ' ' ILE . 1.7 mm? -74.17 -22.29 59.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.264 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -90.37 -27.68 19.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.867 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.98 25.08 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.998 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . 0.577 ' HB2' HD12 ' A' ' 81' ' ' LEU . 12.7 m-20 -103.86 104.26 14.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.959 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . 0.556 ' HB3' HD11 ' A' ' 86' ' ' LEU . 58.4 m 60.71 112.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.866 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.477 HD21 ' HB3' ' A' ' 85' ' ' SER . 0.1 OUTLIER -177.45 -39.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.952 -179.945 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.23 -24.93 17.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.134 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.758 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.0 OUTLIER -70.19 -10.15 57.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.391 179.875 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.549 ' HB ' HG21 ' A' ' 89' ' ' ILE . 17.1 mm -90.8 -56.73 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.59 ' O ' ' HB ' ' B' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.19 64.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.263 177.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . 0.722 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.05 -56.09 3.53 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.201 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.758 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.1 mm? -51.72 -26.15 8.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.891 ' HB3' HD13 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -90.6 -38.58 13.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.676 179.408 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.722 HG22 ' HA ' ' B' ' 91' ' ' ALA . 2.1 t -67.2 -11.34 57.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.075 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.31 -28.44 1.64 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.552 -0.833 . . . . 0.0 113.053 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.446 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.4 OUTLIER -103.0 2.37 34.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.546 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 29.2 p90 -41.14 137.77 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.561 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.923 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.886 0.374 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' B' ' 53' ' ' HIS . 2.5 m-70 -92.52 127.4 38.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.165 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.702 HD12 HG13 ' B' ' 57' ' ' VAL . 6.3 tp -174.11 -90.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.003 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.57 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.6 m 3.02 -100.29 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.557 ' N ' HG22 ' A' ' 55' ' ' THR . 4.8 tp10 -35.97 -69.92 0.1 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.717 HG13 HD12 ' B' ' 54' ' ' LEU . 5.1 t -46.66 -29.93 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.553 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.63 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.4 pt-20 -66.88 -48.25 69.33 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 2.1 m -65.86 -14.63 61.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.201 177.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.431 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -77.03 -75.95 0.19 Allowed 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.835 -179.725 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 1.05 HD13 HD21 ' A' ' 64' ' ' LEU . 3.9 mm? -60.36 -25.3 65.75 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.803 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.556 ' HB2' HD12 ' B' ' 61' ' ' LEU . 11.4 tt0 -73.13 -37.08 66.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.0 mmt180 -58.82 -39.99 82.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.488 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 1.05 HD21 HD13 ' A' ' 61' ' ' LEU . 1.2 pp -78.46 -23.28 46.6 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.238 178.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.51 ' HB3' ' HA ' ' A' ' 62' ' ' GLU . 1.2 tp10 -65.68 -34.56 78.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.475 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -28.18 62.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.422 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.454 ' C ' ' CG ' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -92.68 -0.36 57.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.256 179.849 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.454 ' CG ' ' C ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER 47.13 -88.81 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.592 179.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 67' ' ' LEU . 3.6 tp 64.26 24.69 13.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.684 0.278 . . . . 0.0 110.894 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.5 mt -148.79 -48.55 0.15 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.551 ' H ' HD12 ' A' ' 71' ' ' ILE . 3.8 mp -82.82 -34.22 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.185 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.83 92.52 4.4 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.98 -170.37 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.471 2.114 . . . . 0.0 112.34 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -145.82 85.07 1.68 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.251 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.13 164.49 14.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.585 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.56 49.61 1.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.732 HD13 ' H ' ' A' ' 78' ' ' ASP . 0.2 OUTLIER -179.73 148.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.009 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.732 ' H ' HD13 ' A' ' 77' ' ' LEU . 1.2 p30 -86.97 79.8 8.63 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -50.65 -28.01 8.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.25 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.815 HG22 HD21 ' B' ' 81' ' ' LEU . 21.0 mt -76.7 -60.3 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.953 0.406 . . . . 0.0 110.732 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 1.07 HD22 HD22 ' B' ' 81' ' ' LEU . 2.3 mm? -54.68 -19.56 6.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.764 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.55 -25.11 13.33 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.1 mmm -98.94 -2.01 38.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.51 87.98 2.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.389 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.06 -156.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.733 HD12 ' HB3' ' B' ' 86' ' ' LEU . 4.3 mm? 63.26 29.63 15.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.835 0.35 . . . . 0.0 110.936 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.15 -42.33 1.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.608 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 17.4 t70 -70.71 -9.54 57.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.051 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.676 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.6 mp -88.66 -56.09 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.594 ' HG3' HG21 ' B' ' 89' ' ' ILE . 0.1 OUTLIER -63.41 -19.97 65.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.259 177.869 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.9 -63.74 1.27 Allowed 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.65 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.547 HD23 ' HB2' ' A' ' 96' ' ' LEU . 1.2 tt -51.54 -24.41 5.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.947 0.403 . . . . 0.0 110.431 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.499 ' HB3' HD12 ' B' ' 93' ' ' LEU . 3.8 mm? -90.12 -40.99 11.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.485 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.79 -13.63 59.81 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.167 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.28 -50.23 0.31 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.228 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.612 HD22 ' N ' ' A' ' 96' ' ' LEU . 2.6 mm? -98.12 -2.48 39.91 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.24 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.92 32.96 0.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.834 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.519 HG23 ' CB ' ' A' ' 96' ' ' LEU . 18.3 t . . . . . 0 C--N 1.33 -0.279 0 CA-C-O 120.931 0.396 . . . . 0.0 111.266 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.118 0 CA-C-O 120.851 0.358 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 53' ' ' HIS . 2.5 m-70 -92.74 127.43 38.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.075 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' LEU . . . . . 0.717 HD12 HG13 ' A' ' 57' ' ' VAL . 6.3 tp -174.08 -90.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.031 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.578 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 98.8 m 3.17 -100.37 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.559 ' N ' HG22 ' B' ' 55' ' ' THR . 4.8 tp10 -35.7 -70.15 0.09 Allowed 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' VAL . . . . . 0.702 HG13 HD12 ' A' ' 54' ' ' LEU . 5.3 t -46.68 -30.06 1.26 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.571 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.404 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . 0.636 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.4 pt-20 -66.71 -48.34 69.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 2.1 m -65.73 -14.62 61.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.288 177.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.425 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -77.02 -75.97 0.19 Allowed 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.798 -179.603 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 1.039 HD13 HD21 ' B' ' 64' ' ' LEU . 3.9 mm? -60.39 -25.31 65.81 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 119.74 -0.784 . . . . 0.0 109.793 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.575 ' HB2' HD12 ' A' ' 61' ' ' LEU . 11.3 tt0 -73.05 -37.18 66.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' B' ' 59' ' ' SER . 1.9 mmt180 -58.89 -39.9 82.8 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.542 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 1.039 HD21 HD13 ' B' ' 61' ' ' LEU . 1.2 pp -78.44 -23.33 46.66 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.272 178.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . 0.493 ' HB3' ' HA ' ' B' ' 62' ' ' GLU . 1.1 tp10 -65.64 -34.58 78.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.479 178.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.57 -28.18 62.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.402 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.444 ' C ' ' CG ' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -92.65 -0.23 57.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.266 179.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 46.96 -88.79 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.504 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.442 ' N ' ' O ' ' B' ' 67' ' ' LEU . 0.2 OUTLIER 64.19 24.81 13.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.694 0.283 . . . . 0.0 110.943 -179.849 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 mt -148.86 -48.65 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.91 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' ILE . . . . . 0.547 ' H ' HD12 ' B' ' 71' ' ' ILE . 3.8 mp -82.86 -34.0 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.26 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.95 92.47 4.46 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -68.9 -170.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.46 2.107 . . . . 0.0 112.411 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -146.76 81.04 1.55 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.543 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' B' ' 77' ' ' LEU . 3.6 mt-10 -119.96 12.79 12.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.638 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 66.12 -73.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.752 0.311 . . . . 0.0 110.889 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' B' ' 75' ' ' GLU . 0.5 OUTLIER -49.48 149.4 2.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.902 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' ASP . . . . . 0.508 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 1.4 p30 -93.42 79.52 4.39 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.096 0.474 . . . . 0.0 111.464 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -51.33 -27.79 10.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.062 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.799 HG22 ' CD2' ' A' ' 81' ' ' LEU . 20.9 mt -76.69 -60.24 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.95 0.405 . . . . 0.0 110.755 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 1.07 HD22 HD22 ' A' ' 81' ' ' LEU . 2.3 mm? -54.75 -19.59 6.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.701 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.41 -25.22 13.35 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 8.2 mmm -98.87 -2.04 38.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -178.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.42 88.02 2.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.03 -156.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.053 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.832 HD22 ' CD1' ' A' ' 81' ' ' LEU . 5.9 mp 63.28 29.54 15.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.904 0.383 . . . . 0.0 110.972 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.25 -42.48 1.51 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.732 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 17.4 t70 -70.65 -9.46 57.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.052 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.668 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.6 mp -88.67 -55.98 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' GLU . . . . . 0.59 ' HG3' HG21 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -63.35 -20.04 65.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.338 177.752 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.93 -63.72 1.27 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.614 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' LEU . . . . . 0.541 HD23 ' HB2' ' B' ' 96' ' ' LEU . 1.2 tt -51.52 -24.38 5.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.918 0.389 . . . . 0.0 110.433 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 93' ' ' LEU . . . . . 0.499 HD12 ' HB3' ' A' ' 93' ' ' LEU . 3.9 mm? -90.21 -40.96 11.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.403 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.84 -13.53 59.71 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.223 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.32 -50.2 0.31 Allowed Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.457 -0.878 . . . . 0.0 113.182 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.602 HD22 ' N ' ' B' ' 96' ' ' LEU . 2.6 mm? -98.18 -2.62 39.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.95 33.1 0.13 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.788 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 98' ' ' VAL . . . . . 0.523 HG23 ' CB ' ' B' ' 96' ' ' LEU . 18.6 t . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.227 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.3 p . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.72 0.295 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -170.33 -41.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.231 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -149.6 131.68 15.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 0.0 111.313 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.75 -31.29 6.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.817 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.64 HD23 HG13 ' B' ' 57' ' ' VAL . 9.0 mt 64.47 -80.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.239 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.502 ' C ' ' O ' ' A' ' 54' ' ' LEU . 97.2 m 6.54 -90.5 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.46 -70.05 0.12 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.639 HG13 HD23 ' B' ' 54' ' ' LEU . 4.6 t -50.18 -25.08 2.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.577 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.742 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.39 73.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.62 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.574 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 20.0 m -69.49 -15.72 63.31 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.3 OUTLIER -73.38 -74.03 0.19 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.475 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.4 mm? -62.06 -28.29 69.49 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 119.362 -0.935 . . . . 0.0 109.992 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.536 ' HB2' HD12 ' B' ' 61' ' ' LEU . 2.6 tt0 -65.08 -39.04 92.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.2 ttm105 -66.73 -28.18 68.21 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 177.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.849 HD11 ' CD2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -72.77 -27.42 61.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.748 178.533 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.783 ' O ' HD11 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -78.01 -32.96 51.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.015 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.75 -22.93 45.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.6 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.826 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.9 tm? -77.56 -29.52 52.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.884 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.856 ' CD1' HD12 ' A' ' 71' ' ' ILE . 0.1 OUTLIER 72.34 -165.57 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.778 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.466 ' CB ' ' O ' ' A' ' 68' ' ' PHE . 8.0 tp 86.88 -33.05 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.85 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.849 ' CD2' HD11 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -113.68 -16.39 12.33 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.474 0.178 . . . . 0.0 111.225 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.856 HD12 ' CD1' ' A' ' 68' ' ' PHE . 60.8 mt -51.64 -37.18 19.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.714 0.293 . . . . 0.0 111.271 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.438 ' CG ' ' HD2' ' A' ' 73' ' ' PRO . 1.4 t80 -109.03 142.24 25.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.815 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.438 ' HD2' ' CG ' ' A' ' 72' ' ' PHE . 51.2 Cg_endo -69.15 -28.8 27.74 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.458 2.106 . . . . 0.0 112.291 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -112.13 -179.48 3.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.739 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -98.06 -49.29 4.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.056 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.07 146.47 25.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.023 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.688 HD12 HG13 ' A' ' 80' ' ' ILE . 0.8 OUTLIER -103.13 -80.05 0.52 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.738 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 71.85 -57.58 0.61 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.298 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.39 6.16 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.684 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.688 HG13 HD12 ' A' ' 77' ' ' LEU . 58.0 mt -61.16 -29.97 46.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 111.144 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.787 ' O ' HD12 ' A' ' 86' ' ' LEU . 1.4 mt -73.2 -26.7 61.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.049 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.8 -19.63 22.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.5 mtm -93.01 -22.88 18.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.039 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -86.8 -60.72 1.91 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.65 120.41 0.91 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.882 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.787 HD12 ' O ' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -169.76 -41.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.018 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.4 mtt180 -74.08 -38.74 63.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.029 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.782 ' O ' HD23 ' A' ' 92' ' ' LEU . 5.1 m-20 -70.36 -11.41 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.351 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.698 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.1 mp -91.55 -54.95 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.24 -19.63 64.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.119 177.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.33 4.26 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.158 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.782 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.3 mm? -53.08 -26.18 15.33 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.081 0.467 . . . . 0.0 109.841 178.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.441 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 0.5 OUTLIER -92.55 -38.05 12.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.165 179.206 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.5 m -63.3 -15.05 56.08 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.012 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.7 -28.85 1.11 Allowed Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.41 -0.9 . . . . 0.0 113.395 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.31 5.41 34.54 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 21.9 p90 -36.69 139.56 0.18 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.688 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 28.0 t -71.0 117.39 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.082 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -74.92 -31.05 61.44 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.971 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.77 163.1 15.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.427 ' O ' HG12 ' A' ' 102' ' ' VAL . 1.2 t-20 -115.63 -41.69 3.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.98 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' ' 102' ' ' VAL . 14.1 p 43.9 44.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.653 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.9 p30 42.92 92.18 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.431 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.5 mttm -108.9 -15.77 14.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.25 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -96.58 33.4 1.83 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.926 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.16 179.956 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.821 0.343 . . . . 0.0 111.246 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -123.23 -78.53 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.891 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.58 131.73 13.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.319 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -113.64 -31.29 6.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.858 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.639 HD23 HG13 ' A' ' 57' ' ' VAL . 9.0 mt 64.32 -80.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.215 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.499 ' C ' ' O ' ' B' ' 54' ' ' LEU . 97.6 m 6.39 -90.47 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -70.17 0.11 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.948 0.404 . . . . 0.0 112.083 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.64 HG13 HD23 ' A' ' 54' ' ' LEU . 4.6 t -50.15 -25.0 2.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.562 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.732 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -68.12 -45.43 73.68 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.612 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.578 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 19.9 m -69.45 -15.68 63.33 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 177.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.472 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.3 OUTLIER -73.46 -74.0 0.19 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.505 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.742 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.4 mm? -62.02 -28.34 69.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.841 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.53 ' HB2' HD12 ' A' ' 61' ' ' LEU . 2.6 tt0 -65.15 -38.97 92.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.1 ttm105 -66.82 -28.03 68.03 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.847 HD11 ' CD2' ' B' ' 70' ' ' LEU . 0.1 OUTLIER -72.96 -27.49 61.85 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.567 178.644 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.785 ' O ' HD11 ' B' ' 71' ' ' ILE . 0.1 OUTLIER -77.96 -33.02 51.73 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.027 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -78.67 -23.01 45.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.596 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.838 HD13 ' O ' ' B' ' 67' ' ' LEU . 2.9 tm? -77.47 -29.48 52.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.987 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.858 ' CD1' HD12 ' B' ' 71' ' ' ILE . 0.1 OUTLIER 72.24 -165.46 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.826 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' B' ' 68' ' ' PHE . 0.3 OUTLIER 86.58 -33.01 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.891 179.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.847 ' CD2' HD11 ' B' ' 64' ' ' LEU . 0.1 OUTLIER -113.49 -16.37 12.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.525 0.203 . . . . 0.0 111.254 -179.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.858 HD12 ' CD1' ' B' ' 68' ' ' PHE . 60.9 mt -51.66 -37.1 19.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.767 0.318 . . . . 0.0 111.354 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . 0.441 ' CG ' ' HD2' ' B' ' 73' ' ' PRO . 1.4 t80 -109.04 142.1 24.83 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.774 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' B' ' 72' ' ' PHE . 51.3 Cg_endo -69.14 -28.75 27.84 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.447 2.098 . . . . 0.0 112.361 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 -111.84 179.77 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.875 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -93.45 -60.33 1.8 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.988 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.49 155.72 26.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.856 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.765 HD22 HD12 ' B' ' 80' ' ' ILE . 1.9 mt -109.21 -79.04 0.59 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.785 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 72.85 -57.87 0.62 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.399 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 4.8 mtm -43.91 -53.44 6.12 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.768 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.765 HD12 HD22 ' B' ' 77' ' ' LEU . 58.1 mt -61.1 -30.08 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.057 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 81' ' ' LEU . 1.4 mt -73.11 -26.82 61.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.065 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.0 mttp -91.68 -19.65 22.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.212 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 9.6 mtm -93.05 -22.84 18.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 0.0 111.053 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . 0.405 ' HB3' ' CD1' ' A' ' 81' ' ' LEU . 1.7 m-20 -86.79 -60.76 1.9 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.901 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.68 120.53 0.91 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.98 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.545 ' CA ' HD13 ' B' ' 89' ' ' ILE . 0.5 OUTLIER -169.78 -42.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -73.71 -38.72 64.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.982 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.803 ' O ' HD23 ' B' ' 92' ' ' LEU . 5.1 m-20 -70.38 -11.47 60.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.34 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.711 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.1 mp -91.52 -55.09 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -63.21 -19.55 64.62 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.136 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.16 -54.28 4.29 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.255 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.803 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.3 mm? -53.12 -26.1 15.49 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.047 0.451 . . . . 0.0 109.833 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.445 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -92.56 -38.12 12.08 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.087 179.192 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.6 m -63.21 -15.23 56.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.98 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -124.55 -28.96 1.12 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.412 -0.899 . . . . 0.0 113.37 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.534 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.5 OUTLIER -104.23 5.33 34.7 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.327 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.445 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 21.5 p90 -36.73 139.51 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.68 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 27.2 t -70.94 117.51 14.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.103 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -74.99 -31.05 61.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.96 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.79 163.1 15.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.861 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . 0.435 ' O ' HG12 ' B' ' 102' ' ' VAL . 1.2 t-20 -115.56 -41.71 3.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.023 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.594 HG22 ' O ' ' B' ' 102' ' ' VAL . 14.4 p 43.75 44.8 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.658 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 6.9 p30 42.97 92.09 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.521 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -108.84 -15.89 14.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.174 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -96.25 33.17 1.8 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.79 0.329 . . . . 0.0 111.015 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.174 -179.974 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.805 0.336 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.38 139.35 35.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.639 ' HB1' ' CE1' ' B' ' 53' ' ' HIS . . . -176.84 -162.61 0.08 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.049 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.644 ' CE1' ' HB1' ' B' ' 52' ' ' ALA . 90.0 m-70 65.23 153.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.438 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.624 HD12 ' N ' ' A' ' 54' ' ' LEU . 4.6 mp 64.26 -137.52 0.29 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.705 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.435 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.7 m 27.94 -84.94 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 54' ' ' LEU . 4.1 mm-40 -66.41 -64.43 0.86 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.138 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.623 ' HB ' HG11 ' B' ' 57' ' ' VAL . 20.6 t -56.84 -44.11 81.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.193 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.699 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 4.7 pt-20 -55.4 -48.68 73.99 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-O 121.451 0.643 . . . . 0.0 109.514 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.436 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 1.2 m -64.38 -19.06 65.25 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.654 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.04 -73.85 0.19 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.228 -179.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.694 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.5 mm? -62.97 -25.36 68.33 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 119.715 -0.794 . . . . 0.0 110.09 -179.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.561 ' HB2' HD12 ' B' ' 61' ' ' LEU . 2.5 tt0 -69.33 -38.3 78.11 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.1 OUTLIER -65.38 -30.36 71.17 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 177.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.451 178.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.403 ' HA ' ' HG3' ' B' ' 65' ' ' GLU . 0.0 OUTLIER -73.53 -32.15 64.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.163 178.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.96 -23.12 44.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.843 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.99 -22.84 33.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 63.76 175.65 0.17 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.967 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tp -129.71 -66.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.973 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.5 mt -124.6 47.25 2.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.963 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.18 -58.05 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.086 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -113.73 101.72 54.08 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.82 -51.2 1.36 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.391 2.06 . . . . 0.0 112.348 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.57 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.804 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -175.99 118.22 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.002 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -159.08 -63.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 74.59 5.66 4.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.469 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -130.94 -34.04 1.51 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.659 0.266 . . . . 0.0 111.354 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -28.02 61.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.333 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.67 -65.03 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.005 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.457 ' H ' HD23 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -62.67 -18.75 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.07 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -80.72 -31.83 35.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 mtm -89.1 -18.2 27.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.98 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -94.25 -40.29 10.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.91 0.386 . . . . 0.0 110.847 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.03 139.07 30.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.45 18.16 11.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.112 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.78 23.25 11.0 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.128 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.491 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.9 OUTLIER -73.83 -11.29 60.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.896 0.379 . . . . 0.0 110.936 179.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.711 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.4 mp -93.31 -50.93 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.392 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.83 -21.58 66.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.459 -0.791 . . . . 0.0 108.931 177.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.02 -48.97 7.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.195 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.491 HD12 ' O ' ' A' ' 88' ' ' ASP . 12.7 mt -56.86 -25.27 56.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.202 0.525 . . . . 0.0 109.778 178.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.12 -36.68 11.96 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.225 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.0 m -65.82 -15.41 62.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.933 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.37 -36.36 0.65 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.218 -179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.452 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -97.94 -2.28 40.93 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.4 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 18.2 p90 38.78 75.84 0.07 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.806 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 42.1 t -72.0 141.12 17.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.935 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -154.23 108.08 2.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.894 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -176.98 166.73 2.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.922 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.41 151.54 19.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.89 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.431 HG23 ' N ' ' A' ' 103' ' ' ASN . 14.0 m -148.42 -45.57 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.245 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.431 ' N ' HG23 ' A' ' 102' ' ' VAL . 34.8 m-80 64.85 -175.75 0.17 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.875 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -126.16 152.74 45.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.918 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.28 113.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.936 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.312 -0.852 . . . . 0.0 111.158 179.932 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 13.4 m . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.814 0.34 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 14.7 mtt85 -157.61 36.96 0.27 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.801 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . 0.644 ' HB1' ' CE1' ' A' ' 53' ' ' HIS . . . -176.73 -162.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.181 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.639 ' CE1' ' HB1' ' A' ' 52' ' ' ALA . 89.8 m-70 65.38 153.66 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.027 0.442 . . . . 0.0 111.238 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.622 ' N ' HD12 ' B' ' 54' ' ' LEU . 4.5 mp 64.13 -137.5 0.3 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.768 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.4 m 27.88 -84.83 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' B' ' 54' ' ' LEU . 4.1 mm-40 -66.45 -64.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.794 0.331 . . . . 0.0 111.192 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.623 HG11 ' HB ' ' A' ' 57' ' ' VAL . 20.6 t -56.86 -44.12 81.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.119 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.694 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 4.7 pt-20 -55.54 -48.49 74.64 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.336 0.589 . . . . 0.0 109.477 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 1.2 m -64.5 -19.06 65.36 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.24 -73.66 0.2 Allowed 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.203 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.5 mm? -63.14 -25.16 68.22 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.126 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.531 ' HB2' HD12 ' A' ' 61' ' ' LEU . 2.4 tt0 -69.52 -38.2 77.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 176.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -30.42 71.22 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.52 -28.39 61.87 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.395 178.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.403 ' HG3' ' HA ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -73.5 -32.21 64.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.129 179.037 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -23.2 44.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.834 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -22.86 33.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.145 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 63.81 175.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.911 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 mp -129.59 -67.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 42.7 mt -124.01 47.36 2.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.104 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 2.9 mt -128.27 -58.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . 0.405 ' HA ' ' HD2' ' B' ' 73' ' ' PRO . 7.5 m-85 -113.66 101.79 54.12 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' B' ' 72' ' ' PHE . 36.7 Cg_endo -65.85 -51.19 1.35 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.325 2.017 . . . . 0.0 112.462 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -177.66 -54.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.114 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -152.1 -174.64 4.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.924 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 68.93 114.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.069 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.0 mp -101.64 47.62 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.645 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -127.25 -34.03 2.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.18 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -28.06 62.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.195 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.9 mm -65.61 -65.05 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.988 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.467 ' H ' HD23 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -62.65 -18.8 63.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.04 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -80.7 -31.88 36.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.391 . . . . 0.0 110.742 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 1.2 mtm -88.98 -18.34 27.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.93 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -94.28 -40.18 10.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.774 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 18.3 p -89.12 139.03 30.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.882 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.6 tp -94.51 18.16 11.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 58.91 23.2 11.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.128 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.473 ' O ' HD12 ' B' ' 92' ' ' LEU . 0.9 OUTLIER -73.92 -11.25 60.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.841 0.353 . . . . 0.0 110.893 179.52 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.701 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.4 mp -93.11 -51.06 11.76 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.427 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.02 -21.34 66.83 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.809 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.07 -49.03 7.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.211 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.473 HD12 ' O ' ' B' ' 88' ' ' ASP . 12.7 mt -56.85 -25.27 56.03 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.104 0.478 . . . . 0.0 109.726 178.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.05 -36.76 11.97 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.154 179.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 1.9 m -65.87 -15.45 62.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.814 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.33 -36.46 0.65 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.27 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.445 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.4 OUTLIER -97.96 -2.33 40.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.997 0.399 . . . . 0.0 112.049 -179.363 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.403 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 18.0 p90 38.8 75.79 0.07 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.749 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 41.9 t -71.95 141.02 17.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.043 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -154.07 108.07 3.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.964 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -177.12 166.65 2.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.822 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.32 151.66 19.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.852 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.435 HG23 ' N ' ' B' ' 103' ' ' ASN . 14.0 m -148.49 -45.71 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.182 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . 0.435 ' N ' HG23 ' B' ' 102' ' ' VAL . 35.4 m-80 64.9 -175.7 0.17 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.815 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.23 152.75 45.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.958 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 61.35 113.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.917 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.171 179.969 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.9 t . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.717 0.294 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.685 ' HB3' HD13 ' A' ' 54' ' ' LEU . 1.3 mtt85 -94.42 -47.64 6.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.027 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 51' ' ' ARG . . . 67.42 131.37 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.3 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 51.63 -97.74 0.06 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.929 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.685 HD13 ' HB3' ' A' ' 51' ' ' ARG . 0.4 OUTLIER 66.14 -73.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.601 0.238 . . . . 0.0 111.335 179.424 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.449 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 55.7 m 9.34 -76.54 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.6 pt-20 -63.27 -60.56 3.24 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.67 ' HB ' HG11 ' B' ' 57' ' ' VAL . 17.2 t -59.12 -48.58 86.31 Favored 'Isoleucine or valine' 0 C--O 1.239 0.523 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.651 -179.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.724 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.02 -46.41 68.4 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-O 121.292 0.568 . . . . 0.0 109.555 179.035 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.7 -21.42 66.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.544 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.45 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.3 -71.59 0.25 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.398 -0.819 . . . . 0.0 112.381 -179.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -62.1 -30.68 71.18 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.812 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.453 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 45.7 tt0 -63.29 -37.56 87.73 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.89 -29.93 69.15 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.8 -27.78 64.15 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-O 121.484 0.659 . . . . 0.0 109.516 178.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -78.56 -31.77 47.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.502 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.67 -33.43 66.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.764 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 3.9 mp -63.08 -26.05 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.471 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 3.2 m-85 68.71 -61.0 0.43 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.442 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 70.71 -65.38 0.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.768 0.318 . . . . 0.0 110.667 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 30.9 mt -137.41 53.9 1.85 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.606 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.895 HG23 HG23 ' B' ' 71' ' ' ILE . 36.1 mm -127.14 -45.06 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.187 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.431 ' O ' ' CD2' ' A' ' 72' ' ' PHE . 37.6 p90 -48.0 105.5 0.5 Allowed Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.213 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -79.15 132.65 10.49 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.136 . . . . 0.0 112.289 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.0 -46.86 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.61 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -165.67 65.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.043 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.56 -81.16 0.36 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.7 mt -96.93 112.09 24.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.647 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.491 ' HB3' ' HB2' ' A' ' 81' ' ' LEU . 4.0 t0 -178.94 89.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.98 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.49 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 13.6 ptt? -53.09 -45.26 68.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.684 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.896 HG13 HD11 ' B' ' 81' ' ' LEU . 45.1 mm -65.07 -49.57 78.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.775 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.925 HD11 HG13 ' B' ' 80' ' ' ILE . 1.2 mm? -64.84 -21.29 66.76 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 9.0 pttp -93.54 -24.71 17.87 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.5 ' HE3' HD13 ' A' ' 80' ' ' ILE . 18.5 ptp -93.91 -15.26 25.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.82 -65.37 0.31 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.75 0.309 . . . . 0.0 110.935 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.621 ' O ' HD12 ' A' ' 86' ' ' LEU . 42.9 m 65.04 65.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.651 HD23 HG13 ' B' ' 89' ' ' ILE . 1.5 mp -150.15 32.67 0.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.703 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -112.99 -35.91 5.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.994 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.635 ' O ' HD13 ' A' ' 92' ' ' LEU . 2.3 m-20 -71.75 -13.47 61.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 0.0 111.031 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.786 HG13 HD23 ' B' ' 86' ' ' LEU . 26.2 mm -86.16 -57.37 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.551 ' O ' ' HB ' ' A' ' 94' ' ' THR . 30.2 tt0 -64.13 -18.84 64.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.303 178.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.703 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -83.9 -67.67 0.77 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.525 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.635 HD13 ' O ' ' A' ' 88' ' ' ASP . 6.5 mp -49.31 -29.22 5.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.024 0.44 . . . . 0.0 110.448 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.476 ' HG ' ' HA ' ' B' ' 90' ' ' GLU . 4.3 mm? -85.24 -38.97 18.31 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.5 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.703 HG22 ' HA ' ' A' ' 91' ' ' ALA . 8.7 t -73.16 -7.59 52.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.957 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -113.05 -32.53 2.19 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 96' ' ' LEU . 2.8 mm? -98.31 -7.42 29.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.975 0.388 . . . . 0.0 111.843 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 44.8 p90 31.92 42.03 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.887 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 99' ' ' GLN . 11.4 p -81.42 158.24 4.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.284 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.48 ' N ' HG22 ' A' ' 98' ' ' VAL . 1.0 OUTLIER -112.13 81.45 1.47 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.85 -179.999 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.88 175.73 2.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.895 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -111.32 140.48 45.86 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.956 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 m -148.6 166.66 4.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.141 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -111.98 167.17 10.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.939 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.4 -57.76 2.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.813 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -63.43 -49.08 75.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.913 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.18 179.912 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 81.8 p . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.795 0.331 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' B' ' 52' ' ' ALA . 1.8 mtp180 62.3 -165.44 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.759 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' B' ' 51' ' ' ARG . . . 68.09 131.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.854 0.359 . . . . 0.0 111.055 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.4 ' O ' ' N ' ' B' ' 55' ' ' THR . 5.5 t-80 51.79 -97.75 0.06 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.896 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.606 ' HG ' HG13 ' A' ' 57' ' ' VAL . 0.4 OUTLIER 66.18 -73.94 0.07 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.664 0.268 . . . . 0.0 111.317 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.458 ' O ' ' HG3' ' B' ' 58' ' ' GLU . 57.3 m 9.45 -76.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.6 pt-20 -63.31 -60.47 3.35 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.67 HG11 ' HB ' ' A' ' 57' ' ' VAL . 17.1 t -59.05 -48.63 86.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 O-C-N 122.157 -0.339 . . . . 0.0 111.665 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.741 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.08 -46.37 68.58 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.345 0.593 . . . . 0.0 109.583 179.11 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 21.6 p -64.66 -21.52 66.75 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.536 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.432 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.15 -71.83 0.24 Allowed 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.285 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -62.04 -30.77 71.2 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 119.467 -0.893 . . . . 0.0 109.798 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.455 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 45.6 tt0 -63.14 -37.53 87.6 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -67.79 -29.97 69.29 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.258 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -27.81 64.14 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.498 178.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -78.59 -31.75 47.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.553 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.65 -33.34 66.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.861 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.47 ' O ' ' HB2' ' B' ' 68' ' ' PHE . 3.9 mp -63.11 -26.2 68.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.378 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' B' ' 69' ' ' LEU . 3.2 m-85 68.77 -60.52 0.44 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.631 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' B' ' 68' ' ' PHE . 2.0 mt 69.51 -64.58 0.34 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.818 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' B' ' 70' ' ' LEU . 30.7 mt -137.57 53.86 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.973 0.416 . . . . 0.0 110.666 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.895 HG23 HG23 ' A' ' 71' ' ' ILE . 36.8 mm -127.21 -44.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.173 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . 0.43 ' CD2' ' O ' ' B' ' 72' ' ' PHE . 37.7 p90 -47.96 105.42 0.49 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.212 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -79.11 132.69 10.56 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.532 2.154 . . . . 0.0 112.24 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -165.2 -50.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.12 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.34 31.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.88 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -141.79 136.9 31.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.856 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 mt 65.47 83.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.047 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.473 ' HB3' ' HB2' ' B' ' 81' ' ' LEU . 4.0 t0 -173.36 88.37 0.07 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.856 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.515 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 13.7 ptt? -53.02 -45.2 67.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.639 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.925 HG13 HD11 ' A' ' 81' ' ' LEU . 45.0 mm -65.22 -49.49 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.686 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.896 HD11 HG13 ' A' ' 80' ' ' ILE . 1.2 mm? -64.96 -21.22 66.8 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.515 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 8.9 pttp -93.64 -24.66 17.81 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . 0.518 ' HE3' HD13 ' B' ' 80' ' ' ILE . 18.4 ptp -93.87 -15.22 25.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.621 0.248 . . . . 0.0 111.651 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.74 -65.33 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.726 0.298 . . . . 0.0 110.975 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 43.0 m 65.13 64.89 0.6 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.786 HD23 HG13 ' A' ' 89' ' ' ILE . 1.2 mp -149.43 32.74 0.72 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.738 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 65.7 mtt85 -113.15 -36.05 5.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.199 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.634 ' O ' HD13 ' B' ' 92' ' ' LEU . 2.3 m-20 -71.72 -13.45 61.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 111.047 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.651 HG13 HD23 ' A' ' 86' ' ' LEU . 26.0 mm -86.15 -57.43 4.3 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.473 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 94' ' ' THR . 30.1 tt0 -63.9 -19.08 64.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.354 178.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.709 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -83.84 -67.55 0.78 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.653 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.634 HD13 ' O ' ' B' ' 88' ' ' ASP . 6.5 mp -49.31 -29.37 5.93 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.961 0.41 . . . . 0.0 110.37 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.476 ' HG ' ' HA ' ' A' ' 90' ' ' GLU . 4.3 mm? -85.14 -38.93 18.47 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.56 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.709 HG22 ' HA ' ' B' ' 91' ' ' ALA . 8.8 t -73.15 -7.7 52.55 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.103 -0.639 . . . . 0.0 110.983 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -112.92 -32.49 2.22 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.857 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 2.8 mm? -98.39 -7.39 28.83 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 117.023 0.411 . . . . 0.0 111.753 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 44.5 p90 31.82 42.11 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.843 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.49 HG22 ' N ' ' B' ' 99' ' ' GLN . 11.4 p -81.39 158.26 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.396 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.49 ' N ' HG22 ' B' ' 98' ' ' VAL . 1.0 OUTLIER -112.16 81.54 1.48 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.85 175.7 2.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.9 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -111.3 140.38 45.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.949 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 m -148.54 166.71 4.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.218 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -112.02 166.99 10.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.837 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.29 -57.69 2.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.893 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -63.37 -49.09 75.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.935 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.093 179.964 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.824 0.345 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 30.1 mtt-85 -141.29 154.65 45.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.86 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -172.8 126.9 0.48 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.088 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.642 ' C ' HD12 ' A' ' 54' ' ' LEU . 18.6 p-80 -106.72 86.94 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.036 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.642 HD12 ' C ' ' A' ' 53' ' ' HIS . 11.1 mp -128.41 8.93 6.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.301 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.492 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.2 OUTLIER -52.8 -56.29 16.79 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.612 -179.796 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.66 -42.64 64.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.247 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.738 ' HB ' HG11 ' B' ' 57' ' ' VAL . 2.5 t -62.99 -38.71 82.73 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 CA-C-O 120.868 0.366 . . . . 0.0 111.114 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.679 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -61.22 -52.05 66.42 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.851 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.8 t -61.28 -20.22 62.63 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.291 177.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.437 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 11.4 tpp180 -69.66 -73.59 0.15 Allowed 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.346 -179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.845 HD13 HD22 ' A' ' 64' ' ' LEU . 4.2 mm? -62.63 -30.16 71.15 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.024 -1.071 . . . . 0.0 110.025 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.63 ' HB2' HD12 ' B' ' 61' ' ' LEU . 65.4 tt0 -62.5 -36.67 83.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.314 177.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.86 -15.28 48.77 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.845 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -86.27 -21.48 27.34 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.239 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.549 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 2.4 mm-40 -112.47 -18.32 12.46 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.331 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.29 89.22 0.01 OUTLIER 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.405 ' N ' ' O ' ' A' ' 65' ' ' GLU . 7.0 mt 62.78 17.1 9.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.38 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.417 ' HB3' ' O ' ' A' ' 64' ' ' LEU . 1.4 t80 -103.51 98.4 8.3 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.728 0.299 . . . . 0.0 111.026 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tt -177.19 -72.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.024 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.27 -39.02 0.15 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.915 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.637 HG23 HG12 ' A' ' 80' ' ' ILE . 16.6 mm -48.72 -26.99 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.566 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.73 77.19 0.39 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.847 0.356 . . . . 0.0 111.0 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.26 -46.66 1.34 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.575 2.183 . . . . 0.0 112.3 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.56 74.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.003 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 67.84 -69.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.058 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -70.66 138.67 50.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 pp -100.55 131.4 46.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.912 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.89 -38.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.954 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.06 -23.18 31.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.096 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.637 HG12 HG23 ' A' ' 71' ' ' ILE . 2.9 mp -62.6 -50.76 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.335 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.37 -11.13 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.475 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -88.55 -22.92 23.32 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.67 0.271 . . . . 0.0 111.191 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.5 mtm -116.1 -43.54 2.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.353 . . . . 0.0 111.002 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.53 89.69 3.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.869 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 87.6 p -158.35 154.81 27.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.892 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.08 13.69 18.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.261 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.84 17.21 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.246 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.793 ' O ' HD23 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -73.35 -14.61 61.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.07 179.779 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.415 ' CG2' ' HB ' ' B' ' 89' ' ' ILE . 10.6 mm -92.99 -50.37 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.421 ' OE2' HD23 ' B' ' 93' ' ' LEU . 3.8 tt0 -63.4 -21.86 66.54 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.93 -52.0 5.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.1 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 88' ' ' ASP . 2.3 mm? -52.33 -27.34 14.99 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.182 0.515 . . . . 0.0 109.619 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.596 HD12 HD12 ' B' ' 93' ' ' LEU . 0.2 OUTLIER -91.01 -36.93 13.78 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.04 178.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.21 -13.62 50.12 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.872 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.71 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 113.214 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.54 HD13 ' O ' ' A' ' 96' ' ' LEU . 0.2 OUTLIER -101.22 3.63 41.11 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.559 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.662 ' O ' HG12 ' A' ' 98' ' ' VAL . 21.2 p90 -41.84 133.22 2.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.596 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.662 HG12 ' O ' ' A' ' 97' ' ' PHE . 3.0 p 51.67 168.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.992 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.534 ' H ' HG22 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -159.5 123.94 3.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.703 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.33 147.9 45.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.064 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 59.41 160.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.048 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.5 t 61.45 153.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.14 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -131.0 -178.05 4.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.55 144.45 35.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.87 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.02 163.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.948 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.073 179.967 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 7.2 m . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.801 0.334 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.67 -57.72 2.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.776 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -172.62 126.87 0.5 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.028 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.633 ' C ' HD12 ' B' ' 54' ' ' LEU . 18.3 p-80 -106.83 87.04 2.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.942 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.633 HD12 ' C ' ' B' ' 53' ' ' HIS . 11.0 mp -128.38 8.91 6.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.418 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.489 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -52.77 -56.33 16.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.952 0.406 . . . . 0.0 111.523 -179.787 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.77 -42.59 65.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.227 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.738 HG11 ' HB ' ' A' ' 57' ' ' VAL . 2.4 t -62.82 -38.76 82.64 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-O 120.926 0.393 . . . . 0.0 111.172 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.659 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -61.26 -52.08 66.24 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 7.7 t -61.29 -20.26 62.69 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.381 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.445 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 11.5 tpp180 -69.69 -73.58 0.16 Allowed 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.297 -179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.822 HD13 HD22 ' B' ' 64' ' ' LEU . 4.2 mm? -62.45 -30.45 71.25 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.081 -1.048 . . . . 0.0 110.018 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.634 ' HB2' HD12 ' A' ' 61' ' ' LEU . 65.3 tt0 -62.45 -36.49 82.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.372 177.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -83.94 -15.3 48.4 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.634 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.822 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -86.32 -21.5 27.24 Favored 'General case' 0 CA--C 1.523 -0.093 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.289 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 2.4 mm-40 -112.38 -18.43 12.47 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.384 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.23 89.19 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.952 0.406 . . . . 0.0 111.007 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.403 ' N ' ' O ' ' B' ' 65' ' ' GLU . 7.0 mt 62.92 16.87 9.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.359 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' B' ' 64' ' ' LEU . 1.4 t80 -103.32 98.34 8.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.758 0.314 . . . . 0.0 110.994 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tp -176.93 -73.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.998 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.09 -39.02 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.981 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.613 HG23 HG12 ' B' ' 80' ' ' ILE . 16.5 mm -48.57 -27.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.637 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -105.78 77.22 0.39 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.972 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.1 -46.59 1.43 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.525 2.15 . . . . 0.0 112.429 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.57 74.0 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.953 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 67.8 -67.83 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.145 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.28 138.17 49.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.979 0.418 . . . . 0.0 110.991 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.17 129.98 46.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.828 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -176.55 -38.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.936 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 8.4 mtt -56.07 -23.2 32.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.172 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.613 HG12 HG23 ' B' ' 71' ' ' ILE . 2.9 mp -62.36 -50.95 77.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.376 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.4 -11.0 47.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.55 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -88.66 -22.77 23.26 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.739 0.304 . . . . 0.0 111.265 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.6 mtm -116.26 -43.52 2.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.91 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.57 89.74 3.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 86.5 p -158.4 154.8 27.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.833 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 mt -92.06 13.67 18.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 59.81 27.93 17.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.272 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.777 ' O ' HD23 ' B' ' 92' ' ' LEU . 0.3 OUTLIER -73.36 -14.54 61.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.102 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.415 ' HB ' ' CG2' ' A' ' 89' ' ' ILE . 10.6 mm -93.05 -50.34 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.425 ' OE2' HD23 ' A' ' 93' ' ' LEU . 3.8 tt0 -63.39 -21.82 66.52 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 177.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.04 -51.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.994 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.777 HD23 ' O ' ' B' ' 88' ' ' ASP . 2.3 mm? -52.35 -27.32 15.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.282 0.563 . . . . 0.0 109.597 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.596 HD12 HD12 ' A' ' 93' ' ' LEU . 0.2 OUTLIER -91.08 -36.84 13.78 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.078 178.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.2 m -64.18 -13.71 50.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.916 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.7 -28.95 1.34 Allowed Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.195 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.547 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -101.19 3.72 41.28 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.669 ' O ' HG12 ' B' ' 98' ' ' VAL . 21.4 p90 -41.82 133.16 2.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.698 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.669 HG12 ' O ' ' B' ' 97' ' ' PHE . 3.0 p 51.71 168.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.048 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.53 ' H ' HG22 ' B' ' 98' ' ' VAL . 0.0 OUTLIER -159.39 123.94 3.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.759 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.31 147.87 45.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.085 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 59.46 160.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.047 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 21.4 t 61.47 153.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.121 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -131.05 -178.13 4.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -140.53 144.38 35.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.911 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.98 163.55 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.9 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.164 -179.889 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.771 0.319 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 -170.33 2.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.797 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' CB ' ' A' ' 55' ' ' THR . . . -62.07 -22.78 66.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.255 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.587 ' O ' HG21 ' B' ' 57' ' ' VAL . 14.4 m-70 63.6 -80.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.977 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.506 HD23 HG13 ' B' ' 57' ' ' VAL . 0.8 OUTLIER -94.78 -68.12 0.82 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.827 -179.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.665 ' CB ' ' HB1' ' A' ' 52' ' ' ALA . 97.9 m 22.23 -86.17 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 54' ' ' LEU . 6.8 mt-10 -60.06 -68.34 0.3 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.87 0.367 . . . . 0.0 111.495 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.6 HG21 ' O ' ' B' ' 53' ' ' HIS . 41.4 t -56.77 -21.78 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.672 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.692 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.9 pt-20 -70.31 -45.95 65.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.429 ' N ' ' HG2' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -68.52 -17.15 64.1 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.241 -0.89 . . . . 0.0 108.961 177.136 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 0.4 OUTLIER -73.76 -75.23 0.16 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.529 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.3 mm? -60.62 -29.11 69.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.072 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.659 ' HB2' HD12 ' B' ' 61' ' ' LEU . 3.5 tt0 -66.35 -38.2 87.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 59' ' ' SER . 6.2 ttt85 -66.83 -27.69 67.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.4 HD11 HD21 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -75.42 -27.31 58.96 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.601 178.649 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 8.4 tm-20 -78.29 -30.06 48.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.403 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.42 -31.14 69.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.712 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.49 -10.77 45.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.226 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 63.41 143.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.787 0.327 . . . . 0.0 110.983 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.441 HD11 ' OE1' ' B' ' 65' ' ' GLU . 2.3 mt -93.84 -63.49 1.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.845 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 31.5 mt -147.0 33.53 0.91 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.4 HD12 ' CZ ' ' B' ' 68' ' ' PHE . 23.6 mm -89.74 -58.81 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.218 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.3 112.24 46.7 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.975 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.51 -160.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.52 2.147 . . . . 0.0 112.285 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -134.56 162.1 33.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.348 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 56.52 -157.87 0.26 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.669 0.271 . . . . 0.0 110.927 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -78.41 -38.07 42.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.523 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.5 mt -46.94 114.47 0.85 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.076 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.487 ' OD2' HD11 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -130.72 106.28 8.36 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.13 0.49 . . . . 0.0 112.001 -179.026 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.471 ' HA ' ' HG2' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -68.88 -39.2 79.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.615 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.91 -46.84 95.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.879 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.558 ' CD2' HD23 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -78.95 -25.75 43.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.923 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.471 ' HG2' ' HA ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -84.59 -18.39 35.72 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -179.329 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 32.3 mtm -107.92 -23.29 12.1 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.539 ' CB ' HD13 ' B' ' 81' ' ' LEU . 0.2 OUTLIER -58.19 -75.0 0.05 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.8 0.334 . . . . 0.0 111.304 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -174.27 127.65 0.35 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.116 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.47 HD23 ' O ' ' A' ' 81' ' ' LEU . 1.2 pp -158.43 29.34 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.585 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -97.42 -15.34 20.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.266 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 65.1 m-20 -70.6 -12.09 61.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.913 0.387 . . . . 0.0 111.163 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.644 ' HB ' HG21 ' B' ' 89' ' ' ILE . 11.2 mm -86.92 -57.51 4.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 94' ' ' THR . 40.0 tt0 -63.28 -19.21 64.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.179 177.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.597 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -83.27 -68.64 0.69 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.258 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.439 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.3 tt -47.52 -28.27 2.16 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.118 0.485 . . . . 0.0 110.263 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 89' ' ' ILE . 0.3 OUTLIER -83.25 -40.47 19.55 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.644 179.125 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.597 HG22 ' HA ' ' A' ' 91' ' ' ALA . 4.0 t -69.22 -9.53 53.44 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.889 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.94 -33.57 3.0 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.197 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.7 OUTLIER -87.77 -8.04 56.52 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 120.974 0.416 . . . . 0.0 111.058 179.282 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.434 ' CE1' ' HB ' ' B' ' 98' ' ' VAL . 0.3 OUTLIER 65.98 -152.66 0.24 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.297 -179.466 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.434 ' HB ' ' CE1' ' B' ' 97' ' ' PHE . 21.8 t -145.19 117.06 2.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.754 0.312 . . . . 0.0 111.114 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -148.07 135.9 20.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.843 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 43.68 92.52 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.453 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -138.15 102.28 4.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.927 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.482 HG23 ' N ' ' A' ' 103' ' ' ASN . 31.5 m -125.92 -44.87 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.047 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.482 ' N ' HG23 ' A' ' 102' ' ' VAL . 56.4 m-80 -153.68 -46.49 0.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.959 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp 63.83 129.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.858 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.19 94.02 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.966 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.189 179.961 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.453 HG22 ' H ' ' B' ' 51' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.803 0.335 . . . . 0.0 111.088 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.453 ' H ' HG22 ' B' ' 50' ' ' THR . 7.0 mmt-85 -63.34 177.11 0.69 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.995 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' CB ' ' B' ' 55' ' ' THR . . . -61.47 -22.6 65.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.136 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.6 ' O ' HG21 ' A' ' 57' ' ' VAL . 14.4 m-70 63.58 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.932 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.528 HD23 HG13 ' A' ' 57' ' ' VAL . 0.8 OUTLIER -94.74 -68.05 0.82 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.864 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.665 ' CB ' ' HB1' ' B' ' 52' ' ' ALA . 97.7 m 22.16 -86.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' B' ' 54' ' ' LEU . 6.8 mt-10 -60.0 -68.3 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.852 0.358 . . . . 0.0 111.452 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.587 HG21 ' O ' ' A' ' 53' ' ' HIS . 41.7 t -56.84 -21.74 14.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.658 -179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.691 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.9 pt-20 -70.32 -46.0 65.08 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' HG2' ' B' ' 58' ' ' GLU . 0.3 OUTLIER -68.39 -17.3 64.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.006 177.138 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.526 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 0.4 OUTLIER -73.74 -75.2 0.16 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.553 -179.806 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.3 mm? -60.38 -29.38 68.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.144 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.662 ' HB2' HD12 ' A' ' 61' ' ' LEU . 3.6 tt0 -66.35 -38.09 86.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' B' ' 59' ' ' SER . 6.2 ttt85 -66.88 -27.76 67.77 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -27.29 59.1 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.544 0.687 . . . . 0.0 109.626 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.441 ' OE1' HD11 ' A' ' 69' ' ' LEU . 8.5 tm-20 -78.25 -30.12 48.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.382 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.47 -31.15 69.27 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.669 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.42 -10.8 45.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.353 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.4 ' CZ ' HD12 ' A' ' 71' ' ' ILE . 97.2 m-85 63.56 143.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.814 0.34 . . . . 0.0 110.949 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.0 tp -93.49 -63.62 1.18 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.984 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 30.6 mt -146.83 33.55 0.93 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.855 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -89.71 -58.87 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.166 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -87.24 112.22 46.41 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.952 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.43 -160.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.527 2.151 . . . . 0.0 112.313 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -134.22 164.0 28.36 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -52.65 96.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.168 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 179.06 -38.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.259 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 4.9 tp 179.66 148.53 0.27 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.426 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.49 ' OD2' HD11 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -116.97 104.68 11.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.077 0.465 . . . . 0.0 110.808 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.478 ' HA ' ' HG2' ' B' ' 82' ' ' LYS . 0.0 OUTLIER -68.42 -39.06 81.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.621 -179.429 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.3 mp -62.03 -46.78 95.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.558 HD23 ' CD2' ' A' ' 81' ' ' LEU . 0.2 OUTLIER -79.06 -25.54 43.13 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.0 -178.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . 0.478 ' HG2' ' HA ' ' B' ' 79' ' ' MET . 0.0 OUTLIER -84.84 -18.43 34.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.354 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 32.6 mtm -107.84 -23.18 12.16 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . 0.549 ' CB ' HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -58.39 -74.83 0.06 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.727 0.299 . . . . 0.0 111.257 -179.52 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . 0.452 ' C ' HD23 ' B' ' 86' ' ' LEU . 1.5 m -174.43 127.71 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.194 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.513 HD23 ' N ' ' B' ' 86' ' ' LEU . 0.4 OUTLIER -158.41 28.93 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.613 179.776 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -96.89 -15.45 21.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.284 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 65.4 m-20 -70.73 -12.01 61.3 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.077 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.644 HG21 ' HB ' ' A' ' 89' ' ' ILE . 11.2 mm -86.76 -57.65 4.09 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.582 ' O ' ' HB ' ' B' ' 94' ' ' THR . 40.0 tt0 -63.31 -19.19 64.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.187 177.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.599 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -83.23 -68.63 0.69 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.345 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.435 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.3 tt -47.56 -28.33 2.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.959 0.409 . . . . 0.0 110.128 179.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.559 HD12 ' O ' ' B' ' 89' ' ' ILE . 0.3 OUTLIER -83.18 -40.5 19.61 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.679 179.127 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.599 HG22 ' HA ' ' B' ' 91' ' ' ALA . 4.0 t -69.1 -9.67 53.84 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.841 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -107.98 -33.54 3.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.128 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' B' ' 92' ' ' LEU . 0.7 OUTLIER -87.83 -8.02 56.46 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 121.008 0.432 . . . . 0.0 111.104 179.286 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.434 ' CE1' ' HB ' ' A' ' 98' ' ' VAL . 0.4 OUTLIER 66.01 -152.74 0.24 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.214 -179.544 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.434 ' HB ' ' CE1' ' A' ' 97' ' ' PHE . 21.9 t -145.12 117.02 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 111.15 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -148.02 135.9 21.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.873 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 43.67 92.49 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.411 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -138.12 102.44 4.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.947 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.472 HG23 ' N ' ' B' ' 103' ' ' ASN . 31.3 m -125.92 -44.91 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.048 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . 0.472 ' N ' HG23 ' B' ' 102' ' ' VAL . 56.4 m-80 -153.7 -46.47 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.937 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 63.72 129.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.914 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.37 94.06 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.898 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.257 -0.877 . . . . 0.0 111.162 -179.988 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.834 0.35 . . . . 0.0 111.142 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.75 -49.57 2.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.956 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.55 -60.31 2.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.057 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.723 ' O ' HG22 ' B' ' 57' ' ' VAL . 0.0 OUTLIER 64.99 74.39 0.39 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.143 179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.606 HD23 ' HB2' ' A' ' 58' ' ' GLU . 1.5 mt -147.14 -96.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.516 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 0.2 OUTLIER 37.82 -142.73 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.099 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.71 -64.17 0.19 Allowed 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.703 HG22 ' O ' ' B' ' 53' ' ' HIS . 34.0 t -50.45 -37.21 14.59 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.657 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.3 pt-20 -61.36 -48.09 82.9 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.471 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -66.27 -15.64 63.37 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.381 177.802 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.452 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 29.2 ttm-85 -72.96 -71.35 0.31 Allowed 'General case' 0 CA--C 1.511 -0.55 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.554 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.69 HD13 HD22 ' A' ' 64' ' ' LEU . 4.4 mm? -64.58 -27.29 68.85 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.851 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.448 ' HB2' ' CD1' ' B' ' 61' ' ' LEU . 1.9 tt0 -68.58 -33.44 74.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.57 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.0 OUTLIER -81.4 -19.37 42.73 Favored 'General case' 0 C--O 1.231 0.102 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.452 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.69 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -82.98 -24.01 33.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.253 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' B' ' 65' ' ' GLU . 0.6 OUTLIER -93.93 -65.14 1.01 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.655 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.449 ' O ' ' CB ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.33 133.89 53.55 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.248 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.471 ' O ' HD13 ' A' ' 67' ' ' LEU . 0.5 OUTLIER 83.4 -45.73 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.777 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.65 88.7 3.29 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.969 0.414 . . . . 0.0 110.669 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.07 161.2 38.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.738 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 14.7 mt -60.63 -19.49 58.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.273 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.581 ' O ' HG22 ' A' ' 71' ' ' ILE . 15.7 mm -125.05 27.51 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.643 0.259 . . . . 0.0 111.633 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.435 ' CE2' ' HB2' ' A' ' 74' ' ' ARG . 5.1 p90 -58.04 137.29 84.03 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.006 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.468 2.112 . . . . 0.0 112.335 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.435 ' HB2' ' CE2' ' A' ' 72' ' ' PHE . 0.0 OUTLIER -169.06 -65.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.22 -70.94 0.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.087 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 61.39 154.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.78 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 pp -150.11 26.64 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.136 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 62.56 69.52 0.6 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.935 0.397 . . . . 0.0 110.893 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 29.0 mtp -65.27 -49.16 70.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.692 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.421 HG22 HD11 ' B' ' 81' ' ' LEU . 2.0 mp -76.6 -41.19 34.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.727 HD12 HD12 ' B' ' 81' ' ' LEU . 1.0 OUTLIER -60.15 -30.15 69.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.661 179.665 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.45 -29.75 18.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.392 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.81 -24.24 63.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.769 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.6 96.63 10.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.5 m -54.06 109.92 0.54 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.179 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 pp -139.39 26.39 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.956 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.56 -21.88 13.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.894 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -7.01 49.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.775 0.321 . . . . 0.0 111.105 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.696 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.6 mp -91.79 -54.05 7.93 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.44 ' HG3' HG21 ' B' ' 89' ' ' ILE . 0.0 OUTLIER -66.63 -20.88 66.09 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.2 178.014 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.23 -56.83 3.16 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.265 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.522 HD23 HG11 ' A' ' 98' ' ' VAL . 32.8 tp -54.76 -24.09 20.91 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.095 0.474 . . . . 0.0 110.052 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.694 ' HG ' HG12 ' A' ' 98' ' ' VAL . 11.2 mt -92.24 -39.53 11.48 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.544 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.65 -13.85 61.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.146 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.11 -40.89 0.46 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.422 -0.894 . . . . 0.0 113.345 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 96' ' ' LEU . 3.9 mm? -111.71 -0.44 16.0 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 30.4 p90 39.53 53.4 2.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.603 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.694 HG12 ' HG ' ' A' ' 93' ' ' LEU . 11.6 p -54.16 148.24 2.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.357 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.5 -65.95 0.94 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.968 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -177.01 -39.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.024 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -55.75 131.22 46.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.059 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.422 HG13 ' O ' ' A' ' 102' ' ' VAL . 12.0 p -135.13 126.07 45.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.014 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -82.69 142.53 31.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.85 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 60.58 95.42 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.97 177.43 5.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.888 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.122 -179.965 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.873 0.368 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.34 -50.29 5.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.888 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.76 -60.28 2.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.075 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.703 ' O ' HG22 ' A' ' 57' ' ' VAL . 0.0 OUTLIER 65.06 74.4 0.39 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.033 179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.591 HD23 ' HB2' ' B' ' 58' ' ' GLU . 1.5 mt -147.1 -96.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.5 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.52 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 0.2 OUTLIER 37.67 -142.77 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 179.077 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -32.67 -64.15 0.19 Allowed 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.723 HG22 ' O ' ' A' ' 53' ' ' HIS . 34.6 t -50.6 -37.14 15.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.779 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.667 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.3 pt-20 -61.28 -48.09 83.02 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.468 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 0.2 OUTLIER -66.33 -15.46 63.27 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.521 177.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.465 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 28.8 ttm-85 -73.01 -71.26 0.31 Allowed 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.63 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.694 HD13 HD22 ' B' ' 64' ' ' LEU . 4.4 mm? -64.53 -27.45 68.97 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.842 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.445 ' HB2' HD12 ' A' ' 61' ' ' LEU . 1.9 tt0 -68.53 -33.52 74.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.503 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.0 OUTLIER -81.49 -19.2 42.78 Favored 'General case' 0 C--O 1.231 0.109 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.616 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.694 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -83.01 -23.95 33.05 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.244 179.319 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.497 ' CB ' ' CB ' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -94.06 -65.15 1.01 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.599 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 67' ' ' LEU . 0.0 OUTLIER -64.4 133.97 53.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 179.214 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.465 HD13 ' O ' ' B' ' 67' ' ' LEU . 0.5 OUTLIER 83.33 -45.74 0.12 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.756 -179.328 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -102.68 88.48 3.23 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.867 0.365 . . . . 0.0 110.586 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.573 HD13 ' H ' ' B' ' 70' ' ' LEU . 0.2 OUTLIER -158.11 160.09 36.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.59 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.573 ' H ' HD13 ' B' ' 69' ' ' LEU . 14.7 mt -59.64 -19.56 50.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.273 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.581 HG22 ' O ' ' B' ' 71' ' ' ILE . 15.7 mm -124.98 27.53 2.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.595 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . 0.435 ' CE2' ' HB2' ' B' ' 74' ' ' ARG . 5.1 p90 -58.04 137.34 84.03 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.966 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -77.93 114.7 3.66 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.568 2.179 . . . . 0.0 112.283 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . 0.435 ' HB2' ' CE2' ' B' ' 72' ' ' PHE . 0.0 OUTLIER -168.96 -65.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.114 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -125.31 122.83 37.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.19 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 p30 -66.89 173.73 3.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.789 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp 177.56 -30.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.177 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 64.17 69.24 0.53 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.902 0.382 . . . . 0.0 110.696 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 29.1 mtp -65.16 -49.3 70.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.675 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.42 HG22 HD11 ' A' ' 81' ' ' LEU . 2.0 mp -76.43 -41.25 35.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.875 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.727 HD12 HD12 ' A' ' 81' ' ' LEU . 1.0 OUTLIER -60.15 -30.19 69.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.558 179.765 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.58 -29.7 18.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.296 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 3.2 mmm -69.76 -24.3 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.712 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -89.64 96.57 10.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.638 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 5.4 m -54.01 109.82 0.52 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.601 ' O ' HD12 ' B' ' 86' ' ' LEU . 3.2 pp -139.43 26.67 2.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.992 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.74 -21.92 13.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.922 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' B' ' 92' ' ' LEU . 1.0 OUTLIER -72.99 -6.97 49.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.061 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.694 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.6 mp -91.79 -54.03 7.94 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.351 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.414 ' HG3' HG21 ' A' ' 89' ' ' ILE . 0.0 OUTLIER -66.61 -20.8 66.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.237 177.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.35 -56.69 3.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.247 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.498 HD23 HG11 ' B' ' 98' ' ' VAL . 33.4 tp -54.82 -24.1 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.97 0.414 . . . . 0.0 109.908 178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.7 ' HG ' HG12 ' B' ' 98' ' ' VAL . 11.1 mt -92.28 -39.57 11.44 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.47 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 2.9 m -66.57 -13.94 61.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.13 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -123.06 -40.84 0.47 Allowed Glycine 0 CA--C 1.519 0.3 0 C-N-CA 120.42 -0.895 . . . . 0.0 113.354 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.76 -0.45 15.95 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 30.0 p90 39.52 53.43 2.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.571 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.7 HG12 ' HG ' ' B' ' 93' ' ' LEU . 11.6 p -54.06 148.23 2.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.353 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -80.55 -65.93 0.95 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.939 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -177.02 -39.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.938 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -55.67 131.13 45.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.063 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.425 ' O ' HG13 ' B' ' 102' ' ' VAL . 12.0 p -135.06 125.99 45.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.043 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -82.59 142.53 31.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.833 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt 60.66 95.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.87 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.89 177.42 5.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.944 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.213 -0.898 . . . . 0.0 111.126 179.946 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.803 0.335 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -59.89 110.24 1.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.966 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.66 157.46 42.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.23 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.619 ' O ' HG21 ' B' ' 57' ' ' VAL . 3.1 m-70 -116.75 -66.49 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.63 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.865 HD23 ' OE1' ' A' ' 58' ' ' GLU . 5.0 mp -54.62 -81.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.652 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.426 HG22 ' O ' ' A' ' 54' ' ' LEU . 13.2 t 42.72 -151.19 0.03 OUTLIER 'General case' 0 C--O 1.24 0.576 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 178.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 15.1 mt-10 -38.02 -41.46 0.56 Allowed 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.575 -178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.61 HG21 ' O ' ' B' ' 53' ' ' HIS . 51.6 t -64.44 -42.74 96.16 Favored 'Isoleucine or valine' 0 C--O 1.251 1.143 0 CA-C-O 121.362 0.601 . . . . 0.0 110.922 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.942 ' O ' HD23 ' B' ' 61' ' ' LEU . 1.1 pt-20 -59.04 -54.5 46.34 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.503 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 94.0 p -61.67 -17.56 56.0 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.657 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.464 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.8 -71.49 0.22 Allowed 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.871 -179.115 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.959 HD23 ' O ' ' B' ' 58' ' ' GLU . 0.0 OUTLIER -67.8 -19.97 65.14 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.787 -179.335 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.406 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.21 77.29 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.901 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.6 mtp85 -85.78 -18.66 32.34 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.215 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.803 HD13 ' CD1' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -75.85 -34.22 60.06 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.144 0.497 . . . . 0.0 110.407 179.639 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.551 ' N ' HD23 ' A' ' 64' ' ' LEU . 0.5 OUTLIER -96.49 -28.84 14.22 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.129 179.714 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.03 42.31 3.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.127 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.31 119.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.26 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HB2' ' CD2' ' B' ' 68' ' ' PHE . 4.0 t80 -151.4 124.0 8.45 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.985 0.422 . . . . 0.0 110.971 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tp -175.23 -39.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.07 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -103.82 26.01 9.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 21.6 mt -114.01 -24.87 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.173 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 63.45 123.36 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.732 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -84.17 87.11 1.19 Allowed 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.683 2.255 . . . . 0.0 112.654 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.7 mtp-105 56.47 34.12 23.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.243 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.85 104.54 14.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 75.4 -76.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.494 HD22 HD11 ' B' ' 80' ' ' ILE . 6.6 mp 53.95 68.2 0.89 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.026 0.441 . . . . 0.0 110.88 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -114.3 -19.02 11.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.674 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.1 -40.81 74.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.742 0.306 . . . . 0.0 111.045 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mm -67.3 -44.11 87.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.117 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.831 HD12 HD12 ' B' ' 81' ' ' LEU . 3.7 mp -65.27 -24.3 67.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.921 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.07 -26.81 22.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.937 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 39.7 mtp -85.17 -20.28 30.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.101 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.593 ' HB3' HD21 ' B' ' 81' ' ' LEU . 3.9 t0 -99.5 28.02 4.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.77 0.319 . . . . 0.0 110.98 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t 57.4 168.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.061 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.481 ' CA ' HD13 ' A' ' 89' ' ' ILE . 2.5 mt -176.09 -40.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.897 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.92 -30.62 22.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.811 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.687 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -71.06 -9.93 58.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.169 179.72 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.707 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.4 mp -91.65 -55.97 5.65 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.54 -20.9 65.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.524 -0.762 . . . . 0.0 108.982 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.2 -49.98 6.91 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.883 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.687 HD12 ' O ' ' A' ' 88' ' ' ASP . 4.4 mt -53.97 -26.75 27.43 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 97' ' ' PHE . 3.8 mm? -91.9 -36.88 13.22 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.997 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.19 -14.82 57.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.964 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.47 -29.79 1.26 Allowed Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.498 -0.858 . . . . 0.0 113.21 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.649 ' O ' HG23 ' A' ' 98' ' ' VAL . 1.0 OUTLIER -100.12 2.87 43.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.962 0.381 . . . . 0.0 111.956 -179.521 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.423 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 24.5 p90 -38.89 137.54 0.65 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.679 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 96' ' ' LEU . 21.7 t -141.98 140.69 29.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.991 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -72.86 130.49 40.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.968 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -134.86 150.61 50.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.915 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -57.21 5.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.803 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.8 m -80.21 138.8 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.151 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -97.95 -34.62 10.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.887 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -110.2 113.33 25.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -148.3 31.36 0.83 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.904 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.128 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.797 0.332 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 33.9 mtt85 -149.66 60.42 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.826 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.61 157.32 42.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.203 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.61 ' O ' HG21 ' A' ' 57' ' ' VAL . 3.1 m-70 -116.71 -66.27 1.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.725 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.861 HD23 ' OE1' ' B' ' 58' ' ' GLU . 5.0 mp -54.72 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.726 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.433 HG22 ' O ' ' B' ' 54' ' ' LEU . 13.3 t 42.81 -151.25 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.405 ' N ' HG23 ' B' ' 55' ' ' THR . 14.8 mt-10 -38.04 -41.37 0.56 Allowed 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.613 -178.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.619 HG21 ' O ' ' A' ' 53' ' ' HIS . 52.5 t -64.46 -42.87 96.52 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.297 0.57 . . . . 0.0 110.798 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.959 ' O ' HD23 ' A' ' 61' ' ' LEU . 1.1 pt-20 -58.97 -54.65 44.79 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.509 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 94.1 p -61.47 -17.73 55.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.728 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.65 -71.63 0.21 Allowed 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.857 -179.132 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.942 HD23 ' O ' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -67.69 -19.97 65.23 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 117.802 -1.559 . . . . 0.0 109.834 -179.281 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.44 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 10.6 tt0 -66.92 -34.25 77.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.886 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' B' ' 59' ' ' SER . 2.6 mtp85 -85.7 -18.69 32.38 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.169 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.803 HD13 ' CD1' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -75.88 -34.16 59.99 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.14 0.495 . . . . 0.0 110.365 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.549 ' N ' HD23 ' B' ' 64' ' ' LEU . 0.5 OUTLIER -96.64 -28.78 14.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.115 179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 65.83 42.47 3.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.0 tt 64.22 118.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.465 ' CD2' ' HB2' ' A' ' 68' ' ' PHE . 4.0 t80 -151.28 123.64 8.34 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.024 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -174.75 -39.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.075 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mt -104.16 26.14 9.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.159 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.424 ' HB ' ' CE1' ' B' ' 68' ' ' PHE . 21.4 mt -113.98 -24.82 3.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.246 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 63.54 123.28 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.696 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -84.3 86.92 1.19 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.778 2.318 . . . . 0.0 112.552 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.0 mtp-105 53.88 24.45 4.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.805 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -83.79 -73.55 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.342 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.91 88.16 2.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.937 0.398 . . . . 0.0 110.755 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.63 67.97 0.92 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -105.64 -19.8 13.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -40.75 75.29 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.494 HD11 HD22 ' A' ' 77' ' ' LEU . 34.9 mm -67.34 -44.2 87.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.018 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.831 HD12 HD12 ' A' ' 81' ' ' LEU . 3.6 mp -65.33 -24.09 67.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 44.3 mttt -88.19 -26.82 22.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.98 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 39.8 mtp -85.1 -20.37 30.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.15 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . 0.582 ' HB3' HD21 ' A' ' 81' ' ' LEU . 3.8 t0 -99.48 28.13 4.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.073 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t 57.45 168.05 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.48 ' CA ' HD13 ' B' ' 89' ' ' ILE . 0.5 OUTLIER -176.06 -40.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.926 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -85.75 -30.74 22.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.91 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.681 ' O ' HD12 ' B' ' 92' ' ' LEU . 0.2 OUTLIER -70.89 -10.13 59.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.082 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.688 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.5 mp -91.57 -56.01 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -62.52 -20.9 65.08 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.045 177.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 -49.92 6.97 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.0 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.681 HD12 ' O ' ' B' ' 88' ' ' ASP . 4.4 mt -54.01 -26.74 27.77 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' B' ' 97' ' ' PHE . 3.8 mm? -91.84 -36.92 13.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.013 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.5 m -64.12 -14.87 57.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.986 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -122.41 -29.96 1.24 Allowed Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.199 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.648 ' O ' HG23 ' B' ' 98' ' ' VAL . 1.0 OUTLIER -100.04 2.87 43.76 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.583 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 24.4 p90 -38.82 137.5 0.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.643 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.648 HG23 ' O ' ' B' ' 96' ' ' LEU . 21.7 t -142.0 140.7 29.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.929 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -72.89 130.38 40.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.893 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -134.82 150.6 50.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.903 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -57.33 5.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.739 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 11.9 m -80.22 138.93 18.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.095 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -98.09 -34.35 10.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.938 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.5 mtpm? -110.46 113.25 25.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.798 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -148.22 31.32 0.84 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.954 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.04 179.968 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.812 0.339 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.6 ttt85 -123.84 -73.24 0.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.927 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -136.24 28.51 3.1 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.251 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -126.62 85.38 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.776 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.59 HD12 HG13 ' B' ' 57' ' ' VAL . 19.6 tp -172.7 -100.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.017 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.493 ' C ' ' O ' ' A' ' 54' ' ' LEU . 38.4 m 6.35 -72.75 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -59.96 -68.52 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.997 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.593 HG13 HD12 ' B' ' 54' ' ' LEU . 24.5 t -55.53 -48.56 77.2 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.603 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.2 pt-20 -51.72 -47.29 64.06 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 121.387 0.613 . . . . 0.0 109.469 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.414 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 4.9 t -67.61 -19.51 65.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.577 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.445 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -69.21 -68.53 0.4 Allowed 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.466 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.668 ' HG ' ' HB2' ' B' ' 62' ' ' GLU . 3.6 mm? -62.91 -42.46 99.8 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.802 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.643 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 69.7 tt0 -50.8 -35.96 34.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.255 177.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.45 -26.59 46.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.913 0.387 . . . . 0.0 110.035 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -27.16 68.3 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.3 0.571 . . . . 0.0 109.742 179.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.418 ' O ' ' CG ' ' A' ' 66' ' ' GLN . 25.2 tt0 -99.56 -21.23 15.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.882 178.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CG ' ' O ' ' A' ' 65' ' ' GLU . 17.3 pt20 50.53 35.26 10.92 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.482 -179.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.445 ' O ' ' CB ' ' A' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 11.0 7.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.925 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.817 ' CE1' HD22 ' B' ' 69' ' ' LEU . 0.4 OUTLIER 158.58 137.69 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.471 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.877 ' HG ' HG22 ' A' ' 71' ' ' ILE . 0.7 OUTLIER -66.42 -165.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.34 179.458 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.74 -15.51 58.74 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.877 HG22 ' HG ' ' A' ' 69' ' ' LEU . 0.7 OUTLIER -57.18 -28.86 30.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.716 0.293 . . . . 0.0 111.539 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.19 92.95 5.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.164 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -72.75 -7.6 21.04 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.579 2.186 . . . . 0.0 112.663 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 65.9 49.71 1.61 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.351 . . . . 0.0 110.918 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -176.27 -51.04 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -108.59 135.07 50.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.961 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.401 ' O ' HD12 ' A' ' 77' ' ' LEU . 1.6 pp -109.36 30.12 6.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.96 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 30.54 0.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -49.72 57.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.869 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.415 HG13 HD12 ' A' ' 71' ' ' ILE . 37.9 mm -61.72 -45.51 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.989 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.5 mt -66.11 -30.4 70.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.524 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -74.86 -28.97 60.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.855 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.03 -73.93 0.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.577 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.39 116.4 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.624 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.554 ' HB2' HD21 ' B' ' 86' ' ' LEU . 0.7 OUTLIER 75.49 -161.93 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.777 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 64.92 26.07 12.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.754 0.311 . . . . 0.0 110.751 -179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -148.94 -40.88 0.15 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.912 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.22 -8.3 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.881 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.534 HG21 ' HB ' ' B' ' 89' ' ' ILE . 13.0 mm -89.36 -56.87 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.524 ' O ' ' HB ' ' A' ' 94' ' ' THR . 2.5 tm-20 -64.89 -19.88 66.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.493 178.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.787 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.48 -58.74 2.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.641 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 25.5 tp -55.85 -24.27 35.65 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.289 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.572 ' HG ' HG12 ' A' ' 98' ' ' VAL . 1.0 OUTLIER -92.38 -39.79 11.25 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.066 179.668 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.787 HG22 ' HA ' ' A' ' 91' ' ' ALA . 11.4 t -69.94 -11.49 60.91 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.898 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.33 -35.85 1.06 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.753 -0.737 . . . . 0.0 113.19 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 96' ' ' LEU . 0.2 OUTLIER -95.71 -5.42 42.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 117.015 0.408 . . . . 0.0 112.015 -179.565 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.426 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 25.6 p90 37.26 93.97 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.033 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.572 HG12 ' HG ' ' A' ' 93' ' ' LEU . 12.2 p -105.03 113.93 43.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.184 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.44 154.14 18.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.98 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -159.57 143.79 14.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.886 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -103.13 136.6 42.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.009 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.42 HG23 ' N ' ' A' ' 103' ' ' ASN . 5.9 m -148.7 -47.19 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.42 ' N ' HG23 ' A' ' 102' ' ' VAL . 12.8 m-20 -92.85 128.47 38.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.862 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.81 139.45 46.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.852 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.8 t0 57.7 101.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.241 -0.885 . . . . 0.0 111.18 -179.944 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 9.1 t . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.861 0.362 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.04 57.89 0.66 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.689 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -133.74 28.28 3.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.288 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -126.54 85.43 2.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.768 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.593 HD12 HG13 ' A' ' 57' ' ' VAL . 19.7 tp -172.81 -100.37 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.028 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.483 ' C ' ' O ' ' B' ' 54' ' ' LEU . 38.9 m 6.46 -72.87 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.502 ' N ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -59.95 -68.53 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.007 -178.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.59 HG13 HD12 ' A' ' 54' ' ' LEU . 25.0 t -55.68 -48.17 78.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.714 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.622 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.2 pt-20 -52.01 -47.28 65.04 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.425 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 4.8 t -67.41 -19.56 65.41 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.666 178.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.452 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -69.26 -68.59 0.39 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.426 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.643 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 3.6 mm? -62.9 -42.43 99.78 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 119.377 -0.929 . . . . 0.0 108.742 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.668 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 69.7 tt0 -50.85 -35.83 34.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.579 -1.192 . . . . 0.0 109.249 177.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.6 -26.57 45.43 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.918 0.39 . . . . 0.0 110.014 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -27.2 68.37 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.336 0.588 . . . . 0.0 109.723 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.423 ' O ' ' CG ' ' B' ' 66' ' ' GLN . 25.3 tt0 -99.54 -21.35 15.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.837 178.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 0.423 ' CG ' ' O ' ' B' ' 65' ' ' GLU . 17.3 pt20 50.53 35.32 11.07 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.47 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.45 ' O ' ' CB ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 69.76 10.8 7.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.958 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.548 ' CE1' HD22 ' A' ' 69' ' ' LEU . 0.3 OUTLIER 158.78 138.61 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.632 -179.857 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.817 HD22 ' CE1' ' A' ' 68' ' ' PHE . 2.4 tp -66.06 -166.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.439 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 15.8 mt -63.7 -15.44 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.345 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.441 HD12 HG13 ' B' ' 80' ' ' ILE . 0.7 OUTLIER -57.24 -28.66 30.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.715 0.293 . . . . 0.0 111.549 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.28 93.09 5.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.169 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.82 -7.63 21.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.62 2.213 . . . . 0.0 112.695 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 65.74 49.27 1.75 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.922 0.391 . . . . 0.0 110.836 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -170.64 -61.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.835 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -105.35 139.47 39.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.754 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.0 mt -109.03 34.16 3.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.5 30.41 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.67 -49.75 56.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.441 HG13 HD12 ' B' ' 71' ' ' ILE . 38.0 mm -61.72 -45.49 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 3.6 mt -66.05 -30.39 70.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.585 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -75.0 -28.82 60.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.933 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 30.0 mtm -86.04 -73.92 0.43 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.651 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -70.36 116.35 10.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.597 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 75.67 -162.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.692 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' ' 85' ' ' SER . 1.1 mm? 64.85 26.18 12.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.847 0.356 . . . . 0.0 110.723 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -148.96 -40.91 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.802 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.27 -8.16 51.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.884 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.534 ' HB ' HG21 ' A' ' 89' ' ' ILE . 12.9 mm -89.37 -56.96 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.521 ' O ' ' HB ' ' B' ' 94' ' ' THR . 2.4 tm-20 -64.93 -19.91 66.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.432 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.78 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.33 -58.69 2.49 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.78 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 25.8 tp -55.8 -24.36 35.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.288 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.586 ' HG ' HG12 ' B' ' 98' ' ' VAL . 1.0 OUTLIER -92.25 -39.89 11.27 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.08 179.675 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.78 HG22 ' HA ' ' B' ' 91' ' ' ALA . 11.5 t -69.97 -11.47 60.9 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.895 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.4 -35.89 1.05 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.106 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.427 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -95.62 -5.39 42.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 117.162 0.481 . . . . 0.0 112.105 -179.648 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.431 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 25.9 p90 37.25 94.0 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.13 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.586 HG12 ' HG ' ' B' ' 93' ' ' LEU . 12.1 p -105.13 113.85 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.19 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.33 154.28 18.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.927 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -159.7 143.75 14.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -103.13 136.45 42.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.95 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.408 HG23 ' N ' ' B' ' 103' ' ' ASN . 5.8 m -148.53 -47.17 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.09 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . 0.408 ' N ' HG23 ' B' ' 102' ' ' VAL . 12.5 m-20 -92.92 128.58 38.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.805 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.86 138.78 46.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.893 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 1.8 t0 58.26 101.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.929 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.245 -0.884 . . . . 0.0 111.109 -179.99 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.498 HG22 ' CE1' ' B' ' 53' ' ' HIS . 74.2 p . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.707 0.289 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.8 mtm180 -167.31 -49.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.023 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -165.14 79.42 0.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.328 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.43 ' CE1' ' HA ' ' A' ' 50' ' ' THR . 2.0 p-80 -157.27 27.46 0.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.979 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -101.13 -0.46 36.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.59 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.518 ' HA ' ' HG3' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -56.32 -53.41 57.59 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.79 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.14 -42.05 63.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.75 ' HB ' HG11 ' B' ' 57' ' ' VAL . 2.9 t -62.59 -41.1 90.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.628 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.594 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 2.4 mt-10 -56.61 -64.1 0.98 Allowed 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.6 m -52.88 -20.51 3.37 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.118 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -68.01 -73.25 0.15 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.159 -179.31 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.874 ' CD1' HD13 ' A' ' 64' ' ' LEU . 3.6 mm? -61.83 -24.42 66.88 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.145 -1.022 . . . . 0.0 110.208 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.28 -37.19 86.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.49 177.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -20.39 53.05 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.522 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.874 HD13 ' CD1' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -74.47 -32.07 62.44 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.46 0.647 . . . . 0.0 110.386 179.404 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.574 ' N ' HD23 ' A' ' 64' ' ' LEU . 3.3 mm-40 -92.81 -23.71 18.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.623 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -58.74 -39.03 79.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.017 0.437 . . . . 0.0 110.366 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.554 ' O ' HD23 ' A' ' 67' ' ' LEU . 9.1 tt -76.46 -11.42 59.88 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.969 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 31.5 t80 76.57 130.93 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.91 0.386 . . . . 0.0 111.123 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -145.15 61.04 1.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.737 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.7 52.47 13.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.149 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.408 ' CD1' ' HG2' ' B' ' 66' ' ' GLN . 6.5 tp -99.43 -41.08 9.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.097 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.407 ' N ' HG23 ' A' ' 71' ' ' ILE . 2.9 t80 -78.57 113.52 35.31 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.836 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.1 134.36 59.73 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.361 2.041 . . . . 0.0 112.255 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.6 mtm180 -156.38 89.01 1.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -73.22 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -95.51 121.57 37.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.226 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp 53.9 100.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.128 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.623 ' CB ' HD21 ' A' ' 81' ' ' LEU . 13.1 m-20 -75.69 96.3 3.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.937 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 28.5 mtt -62.5 -25.82 68.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.901 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.03 -55.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.403 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.711 HD12 HD22 ' A' ' 86' ' ' LEU . 0.4 OUTLIER -81.52 -15.68 54.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -179.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.37 -25.98 38.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.814 0.34 . . . . 0.0 110.744 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.54 -22.86 12.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.89 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.04 -68.46 0.44 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.746 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 p -147.88 -92.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.96 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.711 HD22 HD12 ' A' ' 81' ' ' LEU . 12.8 tp 44.78 29.78 0.47 Allowed 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 120.783 0.325 . . . . 0.0 111.414 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.77 -33.42 1.82 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.361 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.77 -10.29 57.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.668 0.27 . . . . 0.0 111.242 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 21.3 mm -88.71 -53.89 8.76 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.473 ' O ' ' HB ' ' A' ' 94' ' ' THR . 33.2 tt0 -67.49 -16.81 64.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.184 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.825 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -88.02 -47.86 8.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.212 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 10.4 mt -64.08 -24.19 67.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.159 0.504 . . . . 0.0 109.756 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.521 HD13 ' O ' ' A' ' 97' ' ' PHE . 1.3 mm? -91.26 -36.85 13.66 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.795 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.825 HG22 ' HA ' ' A' ' 91' ' ' ALA . 9.0 t -75.51 -13.02 60.35 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.0 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.65 -31.11 1.86 Allowed Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.712 -0.756 . . . . 0.0 113.251 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.96 -0.11 12.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 117.151 0.475 . . . . 0.0 112.144 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.542 ' HD2' HG23 ' A' ' 98' ' ' VAL . 0.1 OUTLIER 36.14 -92.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.279 179.485 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.542 HG23 ' HD2' ' A' ' 97' ' ' PHE . 21.6 t -57.57 155.6 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.252 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.419 ' N ' HG12 ' A' ' 98' ' ' VAL . 0.3 OUTLIER -177.64 90.17 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.847 -179.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -128.1 10.55 6.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.29 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 54.65 -172.76 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.82 0.343 . . . . 0.0 111.144 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 10.8 p -114.88 148.06 17.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.935 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 32.0 m120 60.33 -179.38 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.757 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -153.78 -49.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.691 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -58.84 -47.01 86.36 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.088 179.904 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.899 0.38 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -119.13 -57.69 1.99 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.783 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.99 78.99 0.46 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.024 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.498 ' CE1' HG22 ' A' ' 50' ' ' THR . 2.0 p-80 -157.28 27.46 0.3 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.986 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.737 HD22 ' O ' ' B' ' 54' ' ' LEU . 0.0 OUTLIER -101.25 -0.44 35.81 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.605 -179.876 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.522 ' HA ' ' HG3' ' B' ' 58' ' ' GLU . 0.2 OUTLIER -56.33 -53.38 57.94 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.204 0.526 . . . . 0.0 110.778 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -52.16 -42.13 63.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.662 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.75 HG11 ' HB ' ' A' ' 57' ' ' VAL . 2.9 t -62.65 -40.96 90.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.646 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 2.4 mt-10 -56.66 -64.03 1.0 Allowed 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 43.5 m -52.93 -20.45 3.38 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.138 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.456 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -68.13 -73.14 0.15 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.156 -179.331 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.883 HD13 HD13 ' B' ' 64' ' ' LEU . 3.6 mm? -61.9 -24.34 66.89 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.2 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -65.5 -37.05 85.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 177.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -20.4 53.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.566 178.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.883 HD13 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -74.63 -31.95 62.14 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.36 0.6 . . . . 0.0 110.328 179.506 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.583 ' N ' HD23 ' B' ' 64' ' ' LEU . 3.3 mm-40 -92.81 -23.62 18.78 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.718 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 0.408 ' HG2' ' CD1' ' A' ' 71' ' ' ILE . 7.6 mt-30 -58.77 -39.16 80.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.309 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.573 ' O ' HD23 ' B' ' 67' ' ' LEU . 9.2 tt -76.43 -11.41 59.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.025 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' B' ' 67' ' ' LEU . 31.3 t80 76.48 130.99 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.877 0.37 . . . . 0.0 111.216 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.48 60.98 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.696 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 54.0 52.46 12.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.5 tp -99.37 -41.07 9.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.248 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -78.48 113.54 35.26 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.905 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.05 134.17 58.64 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.416 2.078 . . . . 0.0 112.266 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -155.85 87.93 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.798 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -163.67 102.33 0.92 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.468 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 66.45 127.08 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.471 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.74 69.56 0.5 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.02 0.438 . . . . 0.0 110.704 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.626 ' CB ' HD21 ' B' ' 81' ' ' LEU . 12.9 m-20 -72.02 97.25 1.85 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.643 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 28.2 mtt -62.64 -25.7 68.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 mp -61.1 -55.77 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.346 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.626 HD21 ' CB ' ' B' ' 78' ' ' ASP . 0.4 OUTLIER -81.71 -15.53 54.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.484 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -80.41 -26.01 38.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.788 0.327 . . . . 0.0 110.75 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 33.1 mtm -105.53 -22.82 12.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.933 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.0 -68.57 0.43 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.715 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 p -147.86 -92.2 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.91 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.507 HD22 HD12 ' B' ' 81' ' ' LEU . 9.1 tp 44.82 29.76 0.48 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.79 0.328 . . . . 0.0 111.358 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -129.92 -33.35 1.79 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.387 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -69.72 -10.33 57.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.34 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 20.9 mm -88.48 -53.9 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.457 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.456 ' O ' ' HB ' ' B' ' 94' ' ' THR . 33.2 tt0 -67.65 -16.78 64.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.185 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.814 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -88.0 -47.73 8.31 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.332 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.21 -24.11 67.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.135 0.493 . . . . 0.0 109.713 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.531 HD13 ' O ' ' B' ' 97' ' ' PHE . 1.3 mm? -91.29 -36.95 13.58 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.773 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.814 HG22 ' HA ' ' B' ' 91' ' ' ALA . 9.1 t -75.44 -13.1 60.37 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.266 -0.574 . . . . 0.0 111.033 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.59 -31.04 1.88 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.398 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -115.9 -0.11 12.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 117.154 0.477 . . . . 0.0 112.273 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.531 ' O ' HD13 ' B' ' 93' ' ' LEU . 0.1 OUTLIER 36.05 -92.87 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.272 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.528 HG23 ' HD2' ' B' ' 97' ' ' PHE . 21.5 t -57.63 155.58 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.844 0.354 . . . . 0.0 111.308 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.426 ' N ' HG12 ' B' ' 98' ' ' VAL . 0.3 OUTLIER -177.58 90.27 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.888 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -128.14 10.5 6.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.333 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 54.76 -172.86 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.796 0.332 . . . . 0.0 111.007 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.8 p -114.82 148.12 17.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.926 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 32.3 m120 60.33 -179.62 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.882 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt -153.46 -49.7 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.718 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -58.85 -47.12 86.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.77 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.114 179.999 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.761 0.315 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.26 172.24 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.883 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.49 -76.16 0.52 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.117 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.535 ' C ' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -144.87 136.97 25.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.034 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.596 HD12 ' N ' ' A' ' 54' ' ' LEU . 5.0 mp -110.5 -57.52 2.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.618 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.423 ' C ' ' O ' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -21.04 -55.78 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 1.7 mm-40 -58.68 -50.84 72.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.266 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.619 HG12 ' N ' ' B' ' 58' ' ' GLU . 6.1 t -63.92 -53.81 39.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.39 -179.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.786 ' HB2' HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -53.58 -62.39 1.68 Allowed 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.576 ' N ' HD22 ' B' ' 61' ' ' LEU . 29.9 t -48.72 -28.03 3.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.64 177.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 8.7 tpt180 -60.74 -63.86 1.15 Allowed 'General case' 0 C--O 1.242 0.694 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.889 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.925 HD23 ' HB2' ' B' ' 62' ' ' GLU . 1.0 OUTLIER -63.03 -18.22 63.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 118.1 -1.44 . . . . 0.0 109.71 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.908 ' HB2' HD23 ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.34 -37.66 87.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 175.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -68.91 -31.6 70.62 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -63.21 -30.15 71.35 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.086 177.67 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.448 ' N ' HD23 ' A' ' 64' ' ' LEU . 0.6 OUTLIER -80.18 -31.44 38.81 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.049 179.159 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -55.74 -35.93 66.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.56 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.01 -29.99 63.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.524 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.58 102.96 0.78 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.772 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.1 -72.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.26 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.45 ' O ' HG22 ' A' ' 71' ' ' ILE . 4.9 mt -140.48 53.48 1.62 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.85 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 70' ' ' LEU . 7.1 tt 42.84 32.18 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.54 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.15 67.49 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.2 163.91 1.42 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.523 2.149 . . . . 0.0 112.35 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.21 89.34 7.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.863 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.404 ' HB3' HD13 ' A' ' 77' ' ' LEU . 4.2 tp10 -159.96 152.08 20.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -80.87 90.18 5.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.404 HD13 ' HB3' ' A' ' 75' ' ' GLU . 6.9 mp -118.91 175.36 5.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.793 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.434 ' HB2' ' HB2' ' A' ' 81' ' ' LEU . 7.0 p-10 -137.08 59.71 1.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.844 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -45.92 77.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.015 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -57.16 -39.79 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.861 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.803 HD12 HD12 ' B' ' 81' ' ' LEU . 9.3 mp -71.38 -27.91 63.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.788 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.16 -23.3 44.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.199 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 16.4 mtp -95.96 -21.11 18.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.247 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.57 -2.74 37.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.412 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.55 143.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.946 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.531 HD22 HD23 ' A' ' 81' ' ' LEU . 9.7 tp -149.62 26.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.958 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -116.14 -15.96 11.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.287 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.569 ' O ' HD23 ' A' ' 92' ' ' LEU . 67.4 m-20 -71.08 -10.06 59.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.649 0.262 . . . . 0.0 111.22 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.732 ' O ' HD12 ' A' ' 93' ' ' LEU . 20.2 mm -89.68 -55.36 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.501 ' O ' ' HB ' ' A' ' 94' ' ' THR . 20.0 tt0 -66.23 -17.58 64.83 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.275 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.774 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.94 -55.35 3.8 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.555 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.569 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.2 mm? -58.98 -23.44 61.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.115 0.483 . . . . 0.0 110.051 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.732 HD12 ' O ' ' A' ' 89' ' ' ILE . 0.4 OUTLIER -91.43 -40.92 11.15 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.046 179.774 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.774 HG22 ' HA ' ' A' ' 91' ' ' ALA . 10.5 t -71.01 -11.73 61.13 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.226 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.71 -33.64 1.27 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.687 -0.768 . . . . 0.0 113.122 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.01 -2.86 33.4 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.41 ' O ' ' CD2' ' A' ' 97' ' ' PHE . 17.6 p90 40.35 79.64 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.688 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 21.6 t -88.21 104.57 14.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.109 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -106.13 -68.89 0.85 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.983 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.59 155.34 36.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.927 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -115.35 179.35 3.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.902 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 23.1 t -76.1 -41.71 37.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.076 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -154.52 93.5 1.59 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -133.86 -57.8 0.87 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.944 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -161.11 112.43 1.8 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.939 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.067 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.872 0.368 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 -177.0 76.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.762 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.33 -76.21 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.243 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.544 ' C ' HD12 ' B' ' 54' ' ' LEU . 0.0 OUTLIER -144.85 137.02 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.043 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.588 ' N ' HD12 ' B' ' 54' ' ' LEU . 5.0 mp -110.54 -57.51 2.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.641 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.434 ' C ' ' O ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -20.98 -55.8 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 179.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 1.7 mm-40 -58.7 -50.86 72.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.841 0.353 . . . . 0.0 111.287 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.618 HG12 ' N ' ' A' ' 58' ' ' GLU . 6.1 t -63.8 -53.84 39.43 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.767 ' HB2' HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -53.56 -62.4 1.68 Allowed 'General case' 0 C--O 1.235 0.318 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.592 ' N ' HD22 ' A' ' 61' ' ' LEU . 30.1 t -48.73 -28.14 3.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.567 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.527 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 8.7 tpt180 -60.6 -63.83 1.16 Allowed 'General case' 0 C--O 1.244 0.771 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.991 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.908 HD23 ' HB2' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -63.18 -18.07 63.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.111 -1.436 . . . . 0.0 109.808 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.925 ' HB2' HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -65.38 -37.67 87.71 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 175.616 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -68.96 -31.52 70.45 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.574 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 0.0 OUTLIER -63.16 -30.29 71.47 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.05 177.653 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.452 ' N ' HD23 ' B' ' 64' ' ' LEU . 0.6 OUTLIER -80.21 -31.32 38.68 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.638 -1.165 . . . . 0.0 110.125 179.147 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -55.86 -35.87 66.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.563 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -29.87 63.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.541 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -65.64 103.2 0.83 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.647 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 43.7 tp -54.26 -72.35 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.23 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.441 ' O ' HG22 ' B' ' 71' ' ' ILE . 4.8 mt -140.36 53.46 1.63 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.907 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.441 HG22 ' O ' ' B' ' 70' ' ' LEU . 7.1 tt 42.88 32.1 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.651 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -140.16 158.11 67.58 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.927 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.27 163.92 1.45 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.596 2.197 . . . . 0.0 112.28 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.15 89.32 7.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -159.98 151.51 19.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.75 90.07 5.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.58 175.96 5.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.887 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.429 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 6.9 p-10 -137.33 59.69 1.67 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.857 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -45.83 77.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.091 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.7 mm -57.14 -39.83 69.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.803 HD12 HD12 ' A' ' 81' ' ' LEU . 9.3 mp -71.32 -27.99 63.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.753 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -79.1 -23.38 44.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.162 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 16.3 mtp -95.93 -21.13 18.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.186 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.5 -2.83 37.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.378 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 63.53 144.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.829 0.347 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.434 HD23 ' N ' ' B' ' 86' ' ' LEU . 2.2 pt? -149.8 26.02 0.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.952 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 mtp180 -115.92 -16.13 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.276 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.556 ' O ' HD23 ' B' ' 92' ' ' LEU . 67.7 m-20 -70.99 -10.08 59.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.736 0.303 . . . . 0.0 111.261 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.742 ' O ' HD12 ' B' ' 93' ' ' LEU . 20.1 mm -89.63 -55.42 6.3 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.481 ' O ' ' HB ' ' B' ' 94' ' ' THR . 20.0 tt0 -66.13 -17.78 64.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.217 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.794 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.92 -55.33 3.81 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.553 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.556 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.2 mm? -59.05 -23.44 62.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.742 HD12 ' O ' ' B' ' 89' ' ' ILE . 0.4 OUTLIER -91.48 -40.8 11.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.968 179.811 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.794 HG22 ' HA ' ' B' ' 91' ' ' ALA . 10.6 t -71.16 -11.7 61.08 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.138 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -117.73 -33.72 1.26 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.756 -0.735 . . . . 0.0 113.044 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -100.07 -2.8 33.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 117.002 0.401 . . . . 0.0 112.026 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.411 ' O ' ' CD2' ' B' ' 97' ' ' PHE . 17.6 p90 40.46 79.55 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.671 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 21.5 t -88.14 104.51 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.163 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -106.12 -69.0 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.925 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.51 155.37 35.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.92 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -115.37 179.29 4.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.787 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 23.0 t -76.03 -41.71 38.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.12 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -154.62 93.52 1.59 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.85 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -133.86 -57.76 0.87 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.965 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -161.11 112.33 1.79 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.897 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.13 179.937 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.482 HG22 ' H ' ' A' ' 51' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.829 0.347 . . . . 0.0 111.187 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.482 ' H ' HG22 ' A' ' 50' ' ' THR . 4.7 ptp180 -61.33 131.18 49.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.074 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.57 120.24 8.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.831 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.569 ' HB3' HG22 ' B' ' 57' ' ' VAL . 0.2 OUTLIER -145.49 76.61 1.48 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.096 -179.493 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.452 HD23 ' H ' ' A' ' 55' ' ' THR . 0.5 OUTLIER -177.65 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 116.719 -0.218 . . . . 0.0 111.13 -179.623 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.47 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 99.2 m 24.8 -85.3 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.435 ' CB ' ' CD2' ' B' ' 53' ' ' HIS . 4.0 mm-40 -62.74 -68.03 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.893 0.378 . . . . 0.0 111.744 -178.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.562 HG22 ' HB3' ' B' ' 53' ' ' HIS . 1.9 t -55.94 -44.55 78.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.289 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.714 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 3.1 pt-20 -52.98 -48.19 67.63 Favored 'General case' 0 CA--C 1.522 -0.12 0 CA-C-O 121.452 0.644 . . . . 0.0 109.452 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.48 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 27.8 t -66.39 -20.16 65.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.636 178.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 2.2 tpm_? -70.01 -71.73 0.23 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.832 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.845 ' CD1' HD22 ' A' ' 64' ' ' LEU . 3.5 mm? -61.21 -38.77 87.77 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.245 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.559 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 8.0 tt0 -53.41 -39.44 64.32 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.795 176.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 59' ' ' SER . 0.1 OUTLIER -70.25 -28.54 65.32 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.845 HD22 ' CD1' ' A' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.35 68.92 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 68' ' ' PHE . 30.0 tt0 -88.63 -25.48 22.4 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.355 178.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.27 -76.73 0.06 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.924 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.36 42.09 1.87 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.422 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.563 ' CD2' HD21 ' B' ' 64' ' ' LEU . 31.7 p90 -39.46 104.84 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.988 0.423 . . . . 0.0 111.546 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.91 -66.69 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.789 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 71.3 mt -150.27 -79.34 0.13 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.989 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.92 24.65 4.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.378 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.96 91.02 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.011 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.25 108.51 2.0 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.531 2.154 . . . . 0.0 112.304 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.04 146.89 32.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 55.97 177.72 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.078 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -125.12 37.45 4.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.88 35.38 1.88 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.856 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.21 20.33 15.66 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.99 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.15 -28.69 66.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 110.679 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 26.9 mm -79.46 -45.72 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.862 ' HB2' HD23 ' B' ' 81' ' ' LEU . 0.5 OUTLIER -69.43 -24.65 63.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.191 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.27 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.913 0.387 . . . . 0.0 110.891 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 44.4 mtp -57.98 -25.39 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.258 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.03 -59.02 0.45 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.035 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.1 m 64.53 -163.42 0.26 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.801 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.503 HD23 HD12 ' B' ' 86' ' ' LEU . 1.9 mt 70.41 30.28 3.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.33 -53.07 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.699 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.5 m-20 -70.5 -11.43 60.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.919 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.63 ' O ' HD13 ' A' ' 93' ' ' LEU . 26.4 mm -90.3 -52.06 11.07 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.615 ' HA ' HD22 ' B' ' 93' ' ' LEU . 1.5 tt0 -66.02 -17.95 65.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.033 177.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.773 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -87.89 -53.6 4.67 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.583 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 6.1 mp -61.13 -21.22 63.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.054 0.454 . . . . 0.0 110.156 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.63 HD13 ' O ' ' A' ' 89' ' ' ILE . 7.5 mp -94.52 -38.45 10.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.862 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.773 HG22 ' HA ' ' A' ' 91' ' ' ALA . 12.3 t -72.28 -13.47 61.51 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.909 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.36 -32.32 1.06 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.146 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.472 ' O ' ' CG ' ' A' ' 97' ' ' PHE . 0.4 OUTLIER -115.67 5.59 14.31 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.518 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.472 ' CG ' ' O ' ' A' ' 96' ' ' LEU . 39.0 p90 46.22 -145.21 0.21 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.355 -179.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 99' ' ' GLN . 12.4 p -80.03 158.25 4.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.855 0.359 . . . . 0.0 111.166 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.48 ' N ' HG22 ' A' ' 98' ' ' VAL . 6.7 tt0 63.03 144.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.887 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.573 ' HB2' HG12 ' A' ' 102' ' ' VAL . 1.7 p30 -110.38 -33.57 6.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.906 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.79 34.7 19.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.841 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.573 HG12 ' HB2' ' A' ' 100' ' ' ASP . 11.1 p -136.59 158.48 37.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.143 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.49 ' N ' HG22 ' A' ' 102' ' ' VAL . 12.3 m-80 -65.46 107.66 1.74 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.911 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.52 142.15 48.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.912 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -170.89 165.57 7.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.855 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.298 -0.858 . . . . 0.0 111.116 179.927 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.568 HG22 ' O ' ' B' ' 50' ' ' THR . 31.9 m . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.673 0.273 . . . . 0.0 111.19 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -175.34 53.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.089 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.29 119.83 7.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.855 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.562 ' HB3' HG22 ' A' ' 57' ' ' VAL . 0.2 OUTLIER -145.32 76.71 1.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.989 -179.476 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.457 HD23 ' H ' ' B' ' 55' ' ' THR . 0.5 OUTLIER -177.72 -127.48 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.151 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.476 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 99.3 m 24.93 -85.33 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.44 ' CB ' ' CD2' ' A' ' 53' ' ' HIS . 4.0 mm-40 -62.84 -67.97 0.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.873 0.368 . . . . 0.0 111.705 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 53' ' ' HIS . 1.9 t -55.9 -44.71 78.83 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.177 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.702 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 3.1 pt-20 -52.9 -48.23 67.36 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.429 0.633 . . . . 0.0 109.49 179.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.49 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 28.0 t -66.29 -20.24 66.05 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.61 178.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -69.97 -71.71 0.23 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.891 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.837 ' CD1' HD22 ' B' ' 64' ' ' LEU . 3.5 mm? -61.3 -38.7 87.75 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.427 -0.909 . . . . 0.0 109.169 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.551 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 8.0 tt0 -53.56 -39.32 64.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.765 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' B' ' 59' ' ' SER . 0.1 OUTLIER -70.26 -28.59 65.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.837 HD22 ' CD1' ' B' ' 61' ' ' LEU . 0.5 OUTLIER -64.49 -27.43 68.97 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 178.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.449 ' HG2' ' HA ' ' B' ' 68' ' ' PHE . 29.6 tt0 -88.43 -25.65 22.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.45 177.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.53 -76.83 0.06 Allowed 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.815 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -112.43 42.21 1.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.35 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.556 ' CD2' HD21 ' A' ' 64' ' ' LEU . 31.8 p90 -39.43 104.73 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.859 0.361 . . . . 0.0 111.593 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.744 HD23 ' HG ' ' B' ' 70' ' ' LEU . 8.0 tt -145.91 -66.32 0.3 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.891 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.744 ' HG ' HD23 ' B' ' 69' ' ' LEU . 71.7 mt -150.49 -79.43 0.12 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.88 24.6 4.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.316 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 t80 55.98 90.96 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.007 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -69.36 108.57 2.03 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.358 2.039 . . . . 0.0 112.273 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.98 146.92 32.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.963 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -57.95 88.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 p30 -131.07 23.38 4.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 56.82 89.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.227 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -113.9 20.09 16.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.83 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 1.6 mtt -69.2 -28.74 66.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.931 0.396 . . . . 0.0 110.657 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 26.6 mm -79.28 -45.94 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.858 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.862 HD23 ' HB2' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -69.26 -24.66 64.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.29 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -90.24 -66.12 0.95 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.91 0.386 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 44.6 mtp -57.94 -25.47 60.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.226 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 t0 78.05 -59.11 0.45 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.781 0.324 . . . . 0.0 111.019 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 4.0 m 64.68 -163.48 0.26 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.829 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.503 HD12 HD23 ' A' ' 86' ' ' LEU . 0.4 OUTLIER 70.34 30.21 3.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.943 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -133.08 -53.04 0.91 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.728 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.5 m-20 -70.56 -11.42 60.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.881 0.372 . . . . 0.0 110.934 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.635 ' O ' HD13 ' B' ' 93' ' ' LEU . 26.5 mm -90.3 -52.0 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.606 ' HA ' HD22 ' A' ' 93' ' ' LEU . 1.5 tt0 -66.02 -17.87 64.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.086 177.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.81 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.92 -53.66 4.63 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.588 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 6.1 mp -61.02 -21.35 63.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.423 . . . . 0.0 110.0 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.635 HD13 ' O ' ' B' ' 89' ' ' ILE . 7.5 mp -94.62 -38.33 10.9 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.81 HG22 ' HA ' ' B' ' 91' ' ' ALA . 12.4 t -72.29 -13.43 61.5 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.889 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.32 -32.36 1.06 Allowed Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.151 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.478 ' O ' ' CG ' ' B' ' 97' ' ' PHE . 0.5 OUTLIER -115.64 5.59 14.34 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.564 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.478 ' CG ' ' O ' ' B' ' 96' ' ' LEU . 39.0 p90 46.34 -145.28 0.22 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.327 -179.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.479 HG22 ' N ' ' B' ' 99' ' ' GLN . 12.5 p -79.92 158.19 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.814 0.34 . . . . 0.0 111.22 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.479 ' N ' HG22 ' B' ' 98' ' ' VAL . 6.6 tt0 63.07 144.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.881 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . 0.587 ' HB2' HG12 ' B' ' 102' ' ' VAL . 1.7 p30 -110.46 -33.44 6.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.874 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.78 34.62 19.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.84 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.587 HG12 ' HB2' ' B' ' 100' ' ' ASP . 11.0 p -136.55 158.46 37.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.07 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . 0.481 ' N ' HG22 ' B' ' 102' ' ' VAL . 12.4 m-80 -65.47 107.66 1.75 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 17.3 tttt -72.55 142.34 48.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.888 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -170.99 165.48 7.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.945 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.959 -179.957 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 120.937 0.398 . . . . 0.0 111.078 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.6 ptt85 -142.37 179.01 7.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.68 127.55 10.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.451 ' CD2' ' NE2' ' B' ' 53' ' ' HIS . 3.1 t-160 -62.06 83.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.454 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.93 HD12 HG22 ' B' ' 57' ' ' VAL . 2.3 tp 179.79 -33.55 0.01 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.656 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.568 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 5.1 m -45.23 -80.19 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -35.02 -65.44 0.22 Allowed 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.944 HG22 HD12 ' B' ' 54' ' ' LEU . 4.3 t -52.86 -28.99 14.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.234 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.673 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.7 pt-20 -64.92 -48.75 73.02 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.424 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 53.1 p -64.54 -18.61 64.99 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.501 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -75.61 0.12 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.078 -179.709 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.846 HD13 HD22 ' A' ' 64' ' ' LEU . 3.6 mm? -59.97 -29.72 68.62 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.032 -179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.677 ' HB2' HD12 ' B' ' 61' ' ' LEU . 19.6 tt0 -62.89 -39.5 94.7 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.081 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.56 -15.55 58.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.754 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.846 HD22 HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -85.64 -24.28 27.16 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.421 -179.547 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.511 ' O ' HD11 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -104.46 -21.9 13.39 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.78 -179.573 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.595 ' HA ' HD11 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -84.43 2.01 42.71 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.264 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.46 HD23 ' CD2' ' A' ' 68' ' ' PHE . 6.0 tp -114.09 -35.13 5.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 110.916 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.46 ' CD2' HD23 ' A' ' 67' ' ' LEU . 46.9 m-85 -141.61 166.91 23.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.971 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.9 mt 58.95 55.73 4.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.053 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.595 HD11 ' HA ' ' A' ' 66' ' ' GLN . 10.0 mt -129.19 -85.36 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.746 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.56 17.38 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.605 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.82 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.886 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.83 118.0 5.21 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.402 2.068 . . . . 0.0 112.339 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.2 ttt85 -161.86 162.27 29.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.808 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -144.54 133.21 22.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.915 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -177.64 -46.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.887 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 64.32 126.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.055 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.18 46.48 7.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.017 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 27.8 mtp -70.07 -41.18 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.749 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.945 HG22 HD23 ' B' ' 81' ' ' LEU . 12.5 mm -63.5 -51.33 71.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.834 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 1.075 HD22 HD22 ' B' ' 81' ' ' LEU . 0.9 OUTLIER -66.14 -29.03 69.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.854 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.9 -30.0 62.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.992 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.3 -21.6 24.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.05 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.83 102.72 15.31 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.901 0.382 . . . . 0.0 110.78 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.59 87.03 1.21 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.698 ' HB3' HD23 ' B' ' 86' ' ' LEU . 0.4 OUTLIER -114.48 -17.98 11.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -71.4 -8.89 56.75 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.526 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 68.3 m-20 -73.1 -9.85 59.17 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.798 0.333 . . . . 0.0 110.995 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.554 HG22 HG22 ' B' ' 89' ' ' ILE . 7.4 mm -88.6 -53.0 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 94' ' ' THR . 1.6 tt0 -67.02 -20.7 65.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.911 178.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.25 -67.43 0.8 Allowed 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.409 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.534 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.1 tt -52.05 -23.74 5.69 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.02 0.438 . . . . 0.0 110.389 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.903 HD12 HD12 ' B' ' 93' ' ' LEU . 8.1 tt -87.77 -38.43 15.77 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.532 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.405 ' CB ' ' O ' ' A' ' 90' ' ' GLU . 3.8 m -72.76 -10.89 60.32 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.87 -30.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.477 -0.868 . . . . 0.0 113.788 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.06 4.88 3.01 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 93' ' ' LEU . 22.7 p90 40.3 70.57 0.23 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.575 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.844 ' HB ' HD11 ' B' ' 93' ' ' LEU . 13.8 p 42.79 46.42 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.863 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.39 -67.62 0.39 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.913 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -112.69 176.7 4.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.921 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -154.17 130.0 10.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.814 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.9 p -153.64 147.24 14.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.086 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.28 106.84 10.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.963 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 40.9 mttp 61.68 152.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.836 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.93 86.99 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.832 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.055 -179.968 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.861 0.362 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 19.3 mtt85 -92.96 -29.16 16.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.883 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -151.51 127.87 10.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.259 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.451 ' NE2' ' CD2' ' A' ' 53' ' ' HIS . 3.2 t-160 -62.04 83.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.53 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.944 HD12 HG22 ' A' ' 57' ' ' VAL . 2.3 tp 179.84 -33.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.755 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.569 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 5.0 m -45.15 -80.3 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -34.91 -65.53 0.21 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.93 HG22 HD12 ' A' ' 54' ' ' LEU . 4.3 t -52.88 -28.94 14.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.165 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.656 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.7 pt-20 -64.98 -48.62 73.34 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.427 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 53.0 p -64.67 -18.55 65.08 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.512 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -75.54 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.067 -179.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.854 HD13 HD22 ' B' ' 64' ' ' LEU . 3.6 mm? -60.02 -29.71 68.68 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.948 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.658 ' HB2' HD12 ' A' ' 61' ' ' LEU . 19.6 tt0 -62.79 -39.67 94.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.132 177.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -78.54 -15.48 58.53 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.716 178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.854 HD22 HD13 ' B' ' 61' ' ' LEU . 0.0 OUTLIER -85.68 -24.4 27.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.906 0.384 . . . . 0.0 111.339 -179.591 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.517 ' O ' HD11 ' B' ' 70' ' ' LEU . 0.1 OUTLIER -104.47 -21.83 13.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 0.611 ' HA ' HD11 ' B' ' 70' ' ' LEU . 0.0 OUTLIER -84.53 2.2 42.27 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.298 179.47 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.465 HD23 ' CD2' ' B' ' 68' ' ' PHE . 6.0 tp -114.07 -35.18 5.14 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.833 0.349 . . . . 0.0 110.95 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.465 ' CD2' HD23 ' B' ' 67' ' ' LEU . 46.7 m-85 -141.58 166.9 23.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.035 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 mp 58.95 55.56 4.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.093 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.611 HD11 ' HA ' ' B' ' 66' ' ' GLN . 10.0 mt -128.98 -85.41 0.56 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.817 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tt -124.57 17.5 4.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.586 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 59.93 106.2 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.726 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.85 117.87 5.11 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.508 2.139 . . . . 0.0 112.349 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -161.31 160.39 29.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.826 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -119.44 -165.17 1.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.922 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.59 101.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.888 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.77 164.15 18.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 60.77 46.49 8.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.816 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 27.9 mtp -69.92 -41.28 74.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.719 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.903 HG22 HD23 ' A' ' 81' ' ' LEU . 12.4 mm -63.44 -51.35 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.851 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 1.075 HD22 HD22 ' A' ' 81' ' ' LEU . 0.9 OUTLIER -66.17 -28.95 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.873 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 8.4 mmtt -73.85 -30.18 62.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.972 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 19.1 ptp -88.24 -21.59 24.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.064 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -88.78 102.8 15.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.865 0.364 . . . . 0.0 110.744 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.69 87.12 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.01 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.698 HD23 ' HB3' ' A' ' 86' ' ' LEU . 1.9 mp -114.41 -18.19 11.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.269 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -71.36 -8.82 56.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.523 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 68.4 m-20 -73.02 -9.97 59.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.803 0.335 . . . . 0.0 111.04 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.554 HG22 HG22 ' A' ' 89' ' ' ILE . 7.4 mm -88.64 -53.03 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.401 ' O ' ' CB ' ' B' ' 94' ' ' THR . 1.6 tt0 -66.96 -20.71 65.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.947 177.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.18 -67.44 0.79 Allowed 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.529 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.537 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.1 tt -51.96 -23.91 5.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.979 0.419 . . . . 0.0 110.309 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.903 HD12 HD12 ' A' ' 93' ' ' LEU . 8.1 tt -87.72 -38.38 15.86 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.554 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.401 ' CB ' ' O ' ' B' ' 90' ' ' GLU . 3.8 m -72.73 -10.91 60.35 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.155 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -118.92 -30.23 1.66 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.433 -0.889 . . . . 0.0 113.645 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 5.1 mp -136.09 4.97 3.01 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -179.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' B' ' 93' ' ' LEU . 22.8 p90 40.26 70.48 0.24 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.878 0.37 . . . . 0.0 111.618 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.851 ' HB ' HD11 ' A' ' 93' ' ' LEU . 13.7 p 42.99 46.36 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.81 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -67.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.9 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -112.79 176.79 4.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.907 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -154.28 129.9 9.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.875 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.0 p -153.55 147.3 14.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.1 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.33 106.8 10.11 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.917 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.88 151.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.835 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.07 87.09 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.049 -179.958 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.728 0.299 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.52 166.02 11.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.851 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -115.52 85.49 2.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.159 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 179.05 57.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.634 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.665 ' CD2' HG13 ' B' ' 57' ' ' VAL . 0.3 OUTLIER -136.35 -51.49 0.7 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.873 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 54' ' ' LEU . 92.3 m 15.2 -79.82 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.477 ' N ' ' O ' ' A' ' 54' ' ' LEU . 8.4 pt-20 -64.96 -55.95 16.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.632 -179.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.739 ' HB ' HG11 ' B' ' 57' ' ' VAL . 4.6 t -59.6 -50.0 81.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-O 120.524 0.202 . . . . 0.0 111.454 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.782 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.0 OUTLIER -53.11 -49.67 66.03 Favored 'General case' 0 CA--C 1.521 -0.148 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.5 t -61.65 -21.43 64.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.589 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.454 ' CB ' ' O ' ' A' ' 57' ' ' VAL . 0.7 OUTLIER -71.26 -73.17 0.19 Allowed 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.311 -179.337 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.773 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 4.4 mm? -60.85 -27.1 67.85 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.129 -178.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.473 ' HB2' HD12 ' B' ' 61' ' ' LEU . 1.8 tt0 -66.83 -38.81 87.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.376 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.762 ' HG2' HD21 ' A' ' 67' ' ' LEU . 45.2 ttp180 -83.54 -9.18 59.11 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.78 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.953 HD22 ' O ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -91.83 -27.41 17.98 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.03 0.443 . . . . 0.0 111.254 -179.079 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.841 ' HB3' ' HB3' ' B' ' 65' ' ' GLU . 1.4 tp10 -113.5 -48.3 2.95 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 8.4 tt0 -47.0 -43.82 19.71 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.762 HD21 ' HG2' ' A' ' 63' ' ' ARG . 3.3 pp -97.49 22.7 8.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.775 0.321 . . . . 0.0 111.038 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -135.65 96.3 3.42 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 110.649 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.998 HD21 HD23 ' B' ' 69' ' ' LEU . 0.2 OUTLIER -154.97 158.7 39.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.619 -179.649 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.752 ' H ' HD13 ' A' ' 69' ' ' LEU . 31.3 mt -49.74 -28.18 5.8 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.826 0.345 . . . . 0.0 111.064 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 34.1 mm -67.32 -14.33 18.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.275 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.21 106.12 0.59 Allowed Pre-proline 0 C--N 1.332 -0.183 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.8 127.0 13.93 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.403 2.069 . . . . 0.0 112.336 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.27 -40.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.864 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -131.49 177.28 7.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -110.78 75.91 0.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.014 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.25 -39.66 62.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.77 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.537 ' CB ' HD21 ' A' ' 81' ' ' LEU . 50.4 m-20 -146.69 93.77 2.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.868 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.16 -24.48 64.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.081 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.0 mm -63.31 -56.3 18.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.365 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.537 HD21 ' CB ' ' A' ' 78' ' ' ASP . 0.4 OUTLIER -82.89 -10.45 58.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.599 -179.657 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -88.19 -27.3 21.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.55 0.214 . . . . 0.0 111.263 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -16.25 12.86 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.536 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.57 -66.3 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.795 0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.59 -171.32 0.19 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.187 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -168.08 -43.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.786 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.876 ' CB ' ' HB2' ' A' ' 91' ' ' ALA . 38.1 mtt180 -107.89 -67.94 0.93 Allowed 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.826 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 1.6 m-20 21.53 -59.39 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.873 ' N ' ' O ' ' A' ' 87' ' ' ARG . 19.9 mm -84.27 -58.24 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 94' ' ' THR . 3.4 tm-20 -66.13 -12.06 53.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.347 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.876 ' HB2' ' CB ' ' A' ' 87' ' ' ARG . . . -87.22 -57.09 3.09 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.172 0.511 . . . . 0.0 110.054 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 88' ' ' ASP . 0.1 OUTLIER -60.26 -21.28 61.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.869 178.884 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.676 HD23 ' O ' ' A' ' 97' ' ' PHE . 5.1 mt -93.34 -35.43 13.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.921 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.736 HG22 ' HA ' ' A' ' 91' ' ' ALA . 12.8 t -75.61 -12.26 60.18 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.66 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.03 -29.44 1.81 Allowed Glycine 0 C--N 1.334 0.454 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.206 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.61 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -118.88 2.17 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.441 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.676 ' O ' HD23 ' A' ' 93' ' ' LEU . 0.1 OUTLIER 37.67 -93.1 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.167 179.638 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.457 ' O ' HD23 ' A' ' 96' ' ' LEU . 20.1 t -76.79 138.24 20.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.779 0.323 . . . . 0.0 111.238 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -125.69 162.85 24.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.691 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.91 116.15 30.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.873 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -137.73 161.77 35.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.987 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.441 HG22 ' N ' ' A' ' 103' ' ' ASN . 9.9 p -167.34 155.68 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.441 ' N ' HG22 ' A' ' 102' ' ' VAL . 7.2 p30 -101.93 160.51 14.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.916 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.5 tttp 49.53 -174.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.075 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.57 -176.43 0.6 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.925 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.326 -0.845 . . . . 0.0 111.061 179.931 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.483 HG22 ' HB2' ' B' ' 53' ' ' HIS . 14.1 t . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.895 0.378 . . . . 0.0 110.986 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 41.6 ttp85 -53.53 -57.32 11.12 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.264 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -116.58 85.49 2.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.361 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.483 ' HB2' HG22 ' B' ' 50' ' ' THR . 0.2 OUTLIER 179.02 57.45 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.683 ' CD2' HG13 ' A' ' 57' ' ' VAL . 0.3 OUTLIER -136.24 -51.47 0.71 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.9 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.449 ' C ' ' O ' ' B' ' 54' ' ' LEU . 92.2 m 15.16 -79.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' B' ' 54' ' ' LEU . 8.4 pt-20 -65.06 -55.85 16.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.601 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.739 HG11 ' HB ' ' A' ' 57' ' ' VAL . 4.5 t -59.59 -50.0 81.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-O 120.538 0.208 . . . . 0.0 111.461 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.773 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.0 OUTLIER -53.06 -49.68 65.87 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.347 0.594 . . . . 0.0 109.522 179.073 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 12.4 t -61.8 -21.34 64.51 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.511 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.442 ' CB ' ' O ' ' B' ' 57' ' ' VAL . 0.7 OUTLIER -71.38 -73.2 0.19 Allowed 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.417 -0.811 . . . . 0.0 112.267 -179.301 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.782 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 4.4 mm? -60.84 -26.91 67.69 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.207 -178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' B' ' 66' ' ' GLN . 1.8 tt0 -66.89 -38.82 86.98 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.317 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.782 ' HG2' HD21 ' B' ' 67' ' ' LEU . 45.0 ttp180 -83.43 -9.35 59.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.808 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.972 ' O ' HD22 ' B' ' 64' ' ' LEU . 0.0 OUTLIER -91.82 -27.42 17.99 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.01 0.433 . . . . 0.0 111.271 -179.032 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.841 ' HB3' ' HB3' ' A' ' 65' ' ' GLU . 1.4 tp10 -113.53 -48.24 2.95 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' B' ' 62' ' ' GLU . 8.4 tt0 -46.99 -43.69 19.55 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.782 HD21 ' HG2' ' B' ' 63' ' ' ARG . 3.3 pp -97.56 22.71 8.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.724 0.297 . . . . 0.0 111.003 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -135.6 97.15 3.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.861 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.998 HD23 HD21 ' A' ' 69' ' ' LEU . 0.3 OUTLIER -156.12 160.93 40.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.814 179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 31.9 mt -51.12 -28.46 10.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.695 ' HB ' HD13 ' B' ' 69' ' ' LEU . 33.9 mm -67.34 -14.17 17.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.391 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -49.18 106.02 0.57 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.236 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.66 127.05 14.11 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.41 2.074 . . . . 0.0 112.387 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.16 -39.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.855 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.99 -176.32 3.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -78.52 -69.92 0.53 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.94 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.6 mt 68.82 -68.1 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.541 ' CB ' HD21 ' B' ' 81' ' ' LEU . 50.3 m-20 -147.19 94.05 2.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.7 ptt? -60.25 -24.51 64.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.09 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 39.3 mm -63.38 -56.17 18.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.315 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.541 HD21 ' CB ' ' B' ' 78' ' ' ASP . 0.4 OUTLIER -82.97 -10.5 58.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.689 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -88.07 -27.33 22.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.685 0.279 . . . . 0.0 111.404 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.51 -16.18 12.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.621 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 3.6 t0 70.5 -66.36 0.29 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.777 0.322 . . . . 0.0 111.012 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.7 -171.26 0.19 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.974 0.416 . . . . 0.0 111.026 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -168.15 -43.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.763 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.877 ' CB ' ' HB2' ' B' ' 91' ' ' ALA . 38.7 mtt180 -108.23 -67.9 0.94 Allowed 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.769 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 1.6 m-20 21.71 -59.54 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.872 ' N ' ' O ' ' B' ' 87' ' ' ARG . 20.4 mm -84.33 -58.22 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.507 ' O ' ' HB ' ' B' ' 94' ' ' THR . 3.4 tm-20 -66.0 -12.19 53.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.392 177.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.877 ' HB2' ' CB ' ' B' ' 87' ' ' ARG . . . -87.15 -57.03 3.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.138 0.494 . . . . 0.0 110.084 178.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.422 ' HB2' ' O ' ' B' ' 88' ' ' ASP . 0.1 OUTLIER -60.15 -21.29 61.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.985 178.78 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.675 HD23 ' O ' ' B' ' 97' ' ' PHE . 5.1 mt -93.32 -35.52 13.02 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.929 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.713 HG22 ' HA ' ' B' ' 91' ' ' ALA . 12.6 t -75.53 -12.26 60.19 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.752 179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.04 -29.55 1.78 Allowed Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.722 -0.752 . . . . 0.0 113.137 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.62 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.6 OUTLIER -118.78 2.16 11.61 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.492 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.675 ' O ' HD23 ' B' ' 93' ' ' LEU . 0.1 OUTLIER 37.78 -93.2 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.022 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.461 ' O ' HD23 ' B' ' 96' ' ' LEU . 20.0 t -76.85 138.29 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.863 0.363 . . . . 0.0 111.27 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -125.71 162.81 24.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.597 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.76 116.1 30.16 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.007 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -137.82 161.76 35.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.999 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.437 HG22 ' N ' ' B' ' 103' ' ' ASN . 10.0 p -167.33 155.49 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.021 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . 0.437 ' N ' HG22 ' B' ' 102' ' ' VAL . 7.2 p30 -101.52 161.0 13.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.942 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' B' ' 103' ' ' ASN . 0.0 OUTLIER 48.26 -173.35 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.291 -179.704 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.81 -176.19 0.56 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.924 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.077 -179.972 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.973 0.416 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.1 tpp180 -113.87 -31.06 6.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.134 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -145.72 29.06 1.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.375 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 59.76 111.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.875 0.369 . . . . 0.0 110.889 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.964 HD23 HG22 ' B' ' 57' ' ' VAL . 1.3 mt -119.15 -17.15 9.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.811 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.521 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 92.7 m -53.6 -84.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -178.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.29 -60.93 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.951 HG22 HD23 ' B' ' 54' ' ' LEU . 3.3 t -56.73 -39.33 63.06 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 120.918 0.389 . . . . 0.0 111.842 -179.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.81 ' O ' HD13 ' B' ' 61' ' ' LEU . 1.3 pt-20 -58.52 -55.06 39.96 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.478 ' N ' ' CG ' ' A' ' 58' ' ' GLU . 31.4 t -63.53 -14.91 55.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.623 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.523 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 1.7 ttt180 -70.83 -74.03 0.16 Allowed 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.493 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 1.11 HD23 HD22 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -66.17 -20.02 66.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 117.772 -1.571 . . . . 0.0 109.702 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.943 ' CB ' HD22 ' B' ' 61' ' ' LEU . 11.0 tm-20 -64.4 -38.5 91.25 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 175.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -70.91 -29.35 65.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.863 177.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 1.11 HD22 HD23 ' A' ' 61' ' ' LEU . 0.1 OUTLIER -67.47 -28.39 67.82 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.804 178.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -83.71 -31.28 26.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.249 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -29.08 68.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.28 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' A' ' 68' ' ' PHE . 7.3 mt -84.06 -12.18 55.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.019 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.464 ' CE1' ' CG2' ' A' ' 71' ' ' ILE . 83.8 t80 65.54 95.22 0.06 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.873 0.368 . . . . 0.0 110.775 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.497 HD13 ' H ' ' A' ' 70' ' ' LEU . 0.2 OUTLIER -155.22 157.42 37.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.967 -179.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.497 ' H ' HD13 ' A' ' 69' ' ' LEU . 1.0 OUTLIER 54.08 21.65 3.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.68 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.614 HD13 ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -120.96 -48.61 2.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.672 0.273 . . . . 0.0 110.827 179.715 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.496 ' N ' HG23 ' A' ' 71' ' ' ILE . 4.6 m-85 55.84 165.57 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.861 0.363 . . . . 0.0 111.262 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -78.19 126.07 7.53 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.642 2.228 . . . . 0.0 112.263 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.06 -30.58 11.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.993 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -91.98 166.71 12.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.949 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.466 ' OD1' HG23 ' B' ' 80' ' ' ILE . 19.0 t70 -107.82 -43.12 4.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.869 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 mp 63.49 140.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.065 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.574 ' HA ' HD21 ' A' ' 81' ' ' LEU . 1.5 t0 -109.84 -26.29 9.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.953 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.46 -29.1 61.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.073 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.8 mm -65.14 -66.47 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.881 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.824 ' O ' HD13 ' A' ' 86' ' ' LEU . 0.6 OUTLIER -60.22 -19.35 54.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 179.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -81.23 -31.53 33.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.802 0.334 . . . . 0.0 111.027 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 25.4 ptm -92.6 -13.44 29.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.573 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.18 51.73 2.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 111.423 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.0 m 44.92 93.09 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.573 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.824 HD13 ' O ' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -115.9 -28.67 6.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.166 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.34 -11.5 59.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.494 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.547 ' O ' HD12 ' A' ' 92' ' ' LEU . 3.2 m-20 -71.48 -10.43 59.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.718 0.294 . . . . 0.0 111.295 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.8 mm -89.58 -55.52 6.19 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.42 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.545 ' HG3' HD11 ' B' ' 93' ' ' LEU . 38.1 tt0 -66.32 -17.91 65.04 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.303 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.83 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -88.24 -53.42 4.71 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.453 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.547 HD12 ' O ' ' A' ' 88' ' ' ASP . 16.8 mt -58.76 -25.22 62.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.973 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.548 HD11 ' HG3' ' B' ' 90' ' ' GLU . 0.8 OUTLIER -91.99 -39.38 11.7 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.067 179.845 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.83 HG22 ' HA ' ' A' ' 91' ' ' ALA . 10.7 t -70.94 -11.78 61.16 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.008 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.76 -34.76 1.23 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.958 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.402 ' C ' ' CD1' ' A' ' 97' ' ' PHE . 0.1 OUTLIER -98.36 -2.27 39.68 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.945 0.372 . . . . 0.0 111.914 -179.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.402 ' CD1' ' C ' ' A' ' 96' ' ' LEU . 3.4 p90 40.5 -125.94 0.45 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.277 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.478 HG22 ' N ' ' A' ' 99' ' ' GLN . 11.8 p -103.23 157.88 4.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.803 0.335 . . . . 0.0 111.229 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.478 ' N ' HG22 ' A' ' 98' ' ' VAL . 2.7 mt-30 -104.73 101.42 11.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -70.18 102.63 2.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -154.68 151.83 29.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.8 m -110.1 -29.87 2.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -134.86 -179.79 5.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.93 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.06 136.05 33.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.846 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.92 153.19 18.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.925 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.078 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.779 0.323 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -135.62 49.36 2.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.985 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -145.09 28.81 1.21 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.206 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 59.93 111.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.867 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.951 HD23 HG22 ' A' ' 57' ' ' VAL . 1.3 mt -119.21 -17.29 8.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.796 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.524 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 92.5 m -53.53 -84.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -30.32 -60.97 0.17 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.964 HG22 HD23 ' A' ' 54' ' ' LEU . 3.2 t -56.62 -39.33 62.16 Favored 'Isoleucine or valine' 0 C--O 1.25 1.08 0 CA-C-O 120.939 0.399 . . . . 0.0 111.93 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.809 ' O ' HD13 ' A' ' 61' ' ' LEU . 1.2 pt-20 -58.58 -55.06 39.89 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.485 ' N ' ' CG ' ' B' ' 58' ' ' GLU . 31.2 t -63.49 -15.01 56.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.618 177.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.517 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 1.7 ttt180 -70.62 -74.19 0.15 Allowed 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.495 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 1.046 HD23 HD22 ' B' ' 64' ' ' LEU . 0.1 OUTLIER -66.15 -19.97 66.0 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 117.703 -1.599 . . . . 0.0 109.651 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.969 ' HB2' HD22 ' A' ' 61' ' ' LEU . 11.1 tm-20 -64.45 -38.5 91.23 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -70.92 -29.21 65.19 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.909 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 1.046 HD22 HD23 ' B' ' 61' ' ' LEU . 0.1 OUTLIER -67.54 -28.46 67.83 Favored 'General case' 0 CA--C 1.523 -0.088 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.697 178.441 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -83.71 -31.35 26.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.093 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.82 -29.09 68.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.262 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' B' ' 68' ' ' PHE . 7.3 mt -83.95 -12.18 55.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.657 ' O ' HD22 ' B' ' 69' ' ' LEU . 83.7 t80 65.58 95.14 0.06 Allowed 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.801 0.334 . . . . 0.0 110.713 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.657 HD22 ' O ' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -155.25 157.32 37.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 54.15 21.78 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.588 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.609 HD13 ' O ' ' B' ' 71' ' ' ILE . 0.0 OUTLIER -120.97 -48.64 2.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.611 0.243 . . . . 0.0 110.839 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . 0.49 ' N ' HG23 ' B' ' 71' ' ' ILE . 4.6 m-85 55.77 165.66 0.06 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.277 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.34 126.16 7.47 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.541 2.161 . . . . 0.0 112.268 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -102.05 -30.63 11.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.997 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -92.1 167.24 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -108.26 -42.96 4.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.926 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.2 mt 63.52 140.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.985 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.574 ' HA ' HD21 ' B' ' 81' ' ' LEU . 1.5 t0 -109.89 -26.28 9.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -29.21 61.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.016 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.466 HG23 ' OD1' ' A' ' 76' ' ' ASP . 35.6 mm -64.98 -66.44 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.973 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.574 HD21 ' HA ' ' B' ' 78' ' ' ASP . 0.6 OUTLIER -60.3 -19.39 54.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.135 179.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -80.96 -31.69 34.77 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.823 0.344 . . . . 0.0 111.121 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 25.5 ptm -92.63 -13.38 29.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.568 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -86.25 51.75 2.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.781 0.324 . . . . 0.0 111.39 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 6.1 m 45.01 93.05 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.484 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tp -115.82 -28.79 6.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.044 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -77.36 -11.41 59.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.548 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.548 ' O ' HD12 ' B' ' 92' ' ' LEU . 3.1 m-20 -71.51 -10.43 59.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.772 0.32 . . . . 0.0 111.309 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 17.2 mm -89.66 -55.59 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.454 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.548 ' HG3' HD11 ' A' ' 93' ' ' LEU . 38.2 tt0 -66.11 -18.05 65.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.278 177.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.814 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -88.23 -53.39 4.72 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.507 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.548 HD12 ' O ' ' B' ' 88' ' ' ASP . 16.8 mt -58.77 -25.19 62.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.076 0.465 . . . . 0.0 110.083 178.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.545 HD11 ' HG3' ' A' ' 90' ' ' GLU . 0.8 OUTLIER -91.93 -39.45 11.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.117 179.778 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.814 HG22 ' HA ' ' B' ' 91' ' ' ALA . 10.8 t -70.91 -11.88 61.22 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.942 179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -116.67 -34.73 1.24 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.002 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.406 ' C ' ' CD1' ' B' ' 97' ' ' PHE . 0.1 OUTLIER -98.44 -2.09 39.85 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.758 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' B' ' 96' ' ' LEU . 3.4 p90 40.54 -125.93 0.46 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.304 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.476 HG22 ' N ' ' B' ' 99' ' ' GLN . 11.8 p -103.26 157.88 4.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.476 ' N ' HG22 ' B' ' 98' ' ' VAL . 2.7 mt-30 -104.8 101.62 11.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.845 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -70.4 102.61 2.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.879 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -154.6 151.91 29.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 m -110.12 -29.94 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.103 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -134.83 -179.75 5.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.87 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.11 136.06 33.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.876 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.9 153.14 18.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.956 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.117 -179.961 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.821 0.343 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -122.35 77.77 1.44 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.946 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.445 ' O ' ' CG ' ' A' ' 53' ' ' HIS . . . -133.97 -117.29 0.19 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.905 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 52' ' ' ALA . 21.2 p80 43.58 30.06 0.32 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.753 0.311 . . . . 0.0 111.456 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.67 -32.59 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 1.7 m -75.59 -41.25 55.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.441 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.8 -40.97 63.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.928 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.578 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 2.8 t -71.89 -40.94 69.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 120.975 0.417 . . . . 0.0 110.839 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.774 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 24.5 pt-20 -62.63 -48.15 80.64 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.434 ' N ' ' HG3' ' A' ' 58' ' ' GLU . 3.5 m -63.42 -22.67 67.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.309 177.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 57' ' ' VAL . 2.7 mtt-85 -68.54 -71.68 0.21 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.671 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' B' ' 58' ' ' GLU . 3.0 mm? -61.37 -24.79 66.73 Favored 'General case' 0 C--O 1.234 0.253 0 C-N-CA 119.054 -1.058 . . . . 0.0 109.844 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.493 ' HB2' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -65.05 -37.02 86.21 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.69 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -31.13 68.84 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.866 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.518 ' HA ' HD21 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -68.48 -27.77 66.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.293 178.369 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.47 ' HB2' ' HB2' ' B' ' 65' ' ' GLU . 2.2 tm-20 -80.88 -31.58 35.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.473 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.02 -49.47 65.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.76 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.659 HD12 ' O ' ' A' ' 68' ' ' PHE . 3.7 pp -63.0 -26.98 69.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.916 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.659 ' O ' HD12 ' A' ' 67' ' ' LEU . 2.1 m-85 64.68 160.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.934 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.94 88.22 1.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.795 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 51.57 51.67 16.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.107 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 1.044 HD11 HD11 ' B' ' 71' ' ' ILE . 0.5 OUTLIER 41.82 31.35 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.897 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.435 ' HB2' ' CZ ' ' B' ' 68' ' ' PHE . 10.9 t80 68.31 100.96 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -60.62 -174.87 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.684 2.256 . . . . 0.0 112.169 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 66.5 -73.88 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.9 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 66.79 6.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.653 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.64 -46.28 81.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.028 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 tp 60.78 159.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.722 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.649 ' HA ' HD21 ' A' ' 81' ' ' LEU . 5.7 p-10 -136.06 19.81 3.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.168 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.56 -35.4 63.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.833 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.859 HG12 HD13 ' B' ' 71' ' ' ILE . 3.2 mp -64.01 -46.02 95.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' A' ' 78' ' ' ASP . 0.3 OUTLIER -77.08 -27.88 54.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.895 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -27.84 62.55 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.81 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.409 ' HE3' ' HA ' ' A' ' 80' ' ' ILE . 13.5 ptp -95.64 -25.04 16.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.094 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.59 -50.45 9.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.922 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.693 ' OG ' HD21 ' B' ' 86' ' ' LEU . 13.7 p -178.93 130.06 0.11 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.977 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -175.89 -57.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.807 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -80.11 -28.45 38.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.789 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -72.75 -9.41 58.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.849 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.448 ' O ' ' HB2' ' A' ' 93' ' ' LEU . 17.4 mm -89.66 -54.74 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -64.51 -21.11 66.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.197 177.799 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.752 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -86.42 -67.34 0.82 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.717 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 96' ' ' LEU . 71.6 mt -49.01 -26.61 2.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.063 0.459 . . . . 0.0 110.413 179.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.829 HD12 HD12 ' B' ' 93' ' ' LEU . 1.0 OUTLIER -87.87 -44.01 11.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.978 179.672 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.752 HG22 ' HA ' ' A' ' 91' ' ' ALA . 9.8 t -67.79 -8.27 34.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.583 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.71 -29.73 1.65 Allowed Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.022 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 92' ' ' LEU . 0.2 OUTLIER -100.43 -1.65 35.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.864 0.364 . . . . 0.0 111.96 -179.609 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.663 ' O ' HG12 ' A' ' 98' ' ' VAL . 73.9 t80 -65.85 -57.4 8.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.625 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 97' ' ' PHE . 9.9 p 50.68 164.05 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.139 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.486 ' N ' HG22 ' A' ' 98' ' ' VAL . 5.7 mm100 -141.95 109.66 5.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.993 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -111.83 90.46 3.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.836 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.59 174.29 2.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.852 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 5.7 m -117.44 126.99 74.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.079 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 60.13 -179.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -118.87 169.5 9.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.902 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -94.72 -40.45 9.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.869 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.065 -179.945 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.798 0.332 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.6 33.14 4.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.855 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' B' ' 53' ' ' HIS . . . -134.03 -117.21 0.19 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.953 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.437 ' CG ' ' O ' ' B' ' 52' ' ' ALA . 21.3 p80 43.65 29.98 0.32 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.825 0.345 . . . . 0.0 111.535 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 5.6 mt -138.65 -32.6 0.69 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.129 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.425 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 1.8 m -75.66 -41.23 54.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -73.75 -41.01 63.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.922 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.577 ' O ' ' HB2' ' B' ' 60' ' ' ARG . 2.8 t -71.92 -40.83 68.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.083 0.468 . . . . 0.0 110.888 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.762 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.5 pt-20 -62.8 -47.98 81.11 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.433 ' N ' ' HG3' ' B' ' 58' ' ' GLU . 3.5 m -63.52 -22.61 66.99 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.347 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.577 ' HB2' ' O ' ' B' ' 57' ' ' VAL . 2.7 mtt-85 -68.47 -71.65 0.21 Allowed 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.791 -179.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.774 ' HG ' ' O ' ' A' ' 58' ' ' GLU . 3.0 mm? -61.27 -24.91 66.73 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 119.173 -1.011 . . . . 0.0 109.858 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.49 ' HB2' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -64.96 -37.2 86.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 176.713 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -31.13 69.03 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.033 178.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.532 ' HA ' HD21 ' B' ' 67' ' ' LEU . 0.3 OUTLIER -68.37 -27.81 66.57 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.349 178.29 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.47 ' HB2' ' HB2' ' A' ' 65' ' ' GLU . 2.2 tm-20 -80.97 -31.48 34.78 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.414 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -49.58 64.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.795 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.662 HD12 ' O ' ' B' ' 68' ' ' PHE . 3.7 pp -62.89 -27.0 69.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.939 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.662 ' O ' HD12 ' B' ' 67' ' ' LEU . 2.1 m-85 64.64 160.53 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.634 ' O ' HD23 ' B' ' 69' ' ' LEU . 10.2 tt -143.75 88.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.792 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 51.39 51.72 16.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.076 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 1.044 HD11 HD11 ' A' ' 71' ' ' ILE . 0.5 OUTLIER 41.83 31.34 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.869 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 68' ' ' PHE . 10.9 t80 68.32 100.78 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.062 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.45 -174.76 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.638 2.226 . . . . 0.0 112.236 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 66.36 -74.37 0.06 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.051 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.82 -69.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.944 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -66.86 0.24 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 tp 60.03 166.96 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.952 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.637 ' HA ' HD21 ' B' ' 81' ' ' LEU . 5.6 p-10 -136.15 19.87 3.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.088 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -35.42 63.24 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.864 0.364 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.855 HG12 HD13 ' A' ' 71' ' ' ILE . 3.2 mp -64.06 -45.9 95.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.907 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.637 HD21 ' HA ' ' B' ' 78' ' ' ASP . 0.3 OUTLIER -77.26 -27.89 53.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.777 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -27.79 62.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.814 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 13.5 ptp -95.64 -25.07 16.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.023 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -80.57 -50.42 10.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.974 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 13.7 p -178.91 130.12 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.828 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.693 HD21 ' OG ' ' A' ' 85' ' ' SER . 0.2 OUTLIER -175.91 -57.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.827 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -80.25 -28.43 38.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.758 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.65 -9.45 58.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.843 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.443 ' O ' ' HB2' ' B' ' 93' ' ' LEU . 17.0 mm -89.56 -54.75 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 94' ' ' THR . 0.0 OUTLIER -64.48 -21.18 66.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.191 177.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.754 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -86.48 -67.22 0.83 Allowed 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.733 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.424 ' O ' ' HB2' ' B' ' 96' ' ' LEU . 71.5 mt -49.06 -26.65 2.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.13 0.491 . . . . 0.0 110.399 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.829 HD12 HD12 ' A' ' 93' ' ' LEU . 1.0 OUTLIER -87.77 -44.15 11.34 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.007 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.754 HG22 ' HA ' ' B' ' 91' ' ' ALA . 9.7 t -67.75 -8.2 33.62 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 120.224 -0.591 . . . . 0.0 111.549 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.72 -29.74 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.62 -0.8 . . . . 0.0 113.062 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.432 HD13 ' O ' ' B' ' 96' ' ' LEU . 0.2 OUTLIER -100.45 -1.65 35.27 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.963 0.381 . . . . 0.0 111.936 -179.663 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.678 ' O ' HG12 ' B' ' 98' ' ' VAL . 74.4 t80 -65.82 -57.38 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.681 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.678 HG12 ' O ' ' B' ' 97' ' ' PHE . 10.0 p 50.77 164.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.151 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.487 ' N ' HG22 ' B' ' 98' ' ' VAL . 5.7 mm100 -141.95 109.57 5.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.945 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -111.83 90.52 3.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.852 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.54 174.24 2.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.913 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.9 m -117.34 127.01 74.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.197 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 60.2 -179.18 0.1 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.905 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -119.04 169.48 9.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.929 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -94.55 -40.54 9.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.268 -0.872 . . . . 0.0 111.097 -179.912 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.783 0.325 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.37 -170.13 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.948 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.21 63.47 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.132 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.7 p-80 -134.24 147.25 50.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.828 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.619 HD23 HG22 ' B' ' 57' ' ' VAL . 0.5 OUTLIER -136.31 -53.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.575 -179.974 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.1 m 21.5 -86.31 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.22 -68.31 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.974 0.416 . . . . 0.0 111.324 -179.251 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.615 ' HA ' ' HB2' ' A' ' 60' ' ' ARG . 22.6 t -53.82 -27.97 16.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.726 -179.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.718 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 0.8 OUTLIER -66.55 -46.8 74.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.189 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.406 ' N ' ' HG2' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -68.02 -17.33 64.38 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 177.381 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.615 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -71.09 -73.72 0.17 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.663 -179.805 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.826 HD13 HD22 ' A' ' 64' ' ' LEU . 4.1 mm? -62.35 -32.35 73.12 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.69 -179.364 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.687 ' HB2' HD12 ' B' ' 61' ' ' LEU . 3.4 tt0 -61.29 -36.31 79.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.199 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -81.09 -16.1 54.09 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.989 0.423 . . . . 0.0 110.023 178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.983 HD23 ' HG2' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -79.12 -27.19 42.83 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.376 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.983 ' HG2' HD23 ' A' ' 64' ' ' LEU . 7.6 mm-40 -102.86 -21.6 13.99 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.125 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.61 -36.07 83.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.962 0.411 . . . . 0.0 110.171 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 69' ' ' LEU . 0.2 OUTLIER -83.27 -0.35 49.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.742 179.384 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 73.1 m-85 67.4 -96.65 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.067 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 67' ' ' LEU . 0.4 OUTLIER 47.21 28.0 0.92 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.696 0.284 . . . . 0.0 111.155 -179.934 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.8 mt -154.7 -45.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.161 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.824 HD13 ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.43 46.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.093 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.48 ' CG ' ' O ' ' A' ' 72' ' ' PHE . 10.6 p90 -123.28 74.42 50.76 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 120.939 0.4 . . . . 0.0 110.866 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -87.54 16.62 1.88 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.818 2.345 . . . . 0.0 112.867 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.626 HH11 HD21 ' A' ' 77' ' ' LEU . 0.3 OUTLIER -86.64 -58.32 2.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.839 0.352 . . . . 0.0 111.028 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 59.0 27.79 16.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.824 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -153.67 -53.09 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.793 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.626 HD21 HH11 ' A' ' 74' ' ' ARG . 4.6 pp -120.39 -173.45 2.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.808 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.755 ' CG ' HD23 ' A' ' 81' ' ' LEU . 3.0 m-20 -137.49 93.96 2.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.763 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.5 -38.88 88.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.881 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.063 HG22 HD11 ' B' ' 81' ' ' LEU . 42.5 mm -73.51 -43.26 55.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 1.077 HD11 HG22 ' B' ' 80' ' ' ILE . 1.7 mm? -74.18 -22.29 59.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.252 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.912 ' HA ' HD22 ' A' ' 86' ' ' LEU . 2.6 mttt -90.35 -27.71 19.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.81 0.338 . . . . 0.0 110.872 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.84 -23.91 25.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.062 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.589 ' HB2' HD12 ' B' ' 81' ' ' LEU . 12.8 m-20 -103.92 104.15 14.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.04 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.477 ' HB3' HD21 ' B' ' 86' ' ' LEU . 58.3 m 60.85 113.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.972 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.912 HD22 ' HA ' ' A' ' 82' ' ' LYS . 6.4 tp -178.45 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.027 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.69 -25.04 17.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.046 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.757 ' O ' HD23 ' A' ' 92' ' ' LEU . 1.0 OUTLIER -70.24 -10.16 58.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.301 179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.549 HG21 ' HB ' ' B' ' 89' ' ' ILE . 17.1 mm -90.73 -56.79 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.426 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.593 ' O ' ' HB ' ' A' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.22 64.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.22 178.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.696 ' HA ' HG22 ' A' ' 94' ' ' THR . . . -86.96 -56.11 3.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.252 179.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.757 HD23 ' O ' ' A' ' 88' ' ' ASP . 3.1 mm? -51.74 -26.27 9.14 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.891 HD13 ' HB3' ' B' ' 93' ' ' LEU . 0.3 OUTLIER -90.46 -38.51 13.21 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.696 HG22 ' HA ' ' A' ' 91' ' ' ALA . 2.1 t -67.33 -11.22 57.07 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.1 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.25 -28.6 1.62 Allowed Glycine 0 C--N 1.333 0.401 0 C-N-CA 120.486 -0.864 . . . . 0.0 113.052 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.448 ' O ' HD23 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -102.93 2.4 35.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.543 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 93' ' ' LEU . 29.3 p90 -41.05 137.64 1.24 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.556 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.2 p -83.62 145.44 8.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.096 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -145.37 99.02 3.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.955 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -147.51 -46.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.908 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -107.96 128.71 54.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 35.5 m -119.29 -39.29 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.199 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -106.86 37.49 2.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -158.24 163.05 37.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.95 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -106.37 133.45 51.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.873 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.107 179.963 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 120.808 0.337 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.82 177.24 7.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.844 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.58 63.6 1.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.265 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -134.39 147.11 50.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.602 HD23 HG22 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -136.28 -52.83 0.73 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.671 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 97.3 m 21.28 -86.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 179.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.29 -68.24 0.3 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.889 0.376 . . . . 0.0 111.312 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.622 ' HA ' ' HB2' ' B' ' 60' ' ' ARG . 23.1 t -53.86 -28.01 16.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.687 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.7 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -66.42 -46.84 75.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.135 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.408 ' N ' ' HG2' ' B' ' 58' ' ' GLU . 0.3 OUTLIER -67.92 -17.42 64.45 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.394 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.622 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -71.08 -73.75 0.17 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.737 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.832 ' CD1' HD22 ' B' ' 64' ' ' LEU . 4.1 mm? -62.17 -32.36 72.97 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.49 -0.884 . . . . 0.0 109.851 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.67 ' HB2' HD12 ' A' ' 61' ' ' LEU . 3.5 tt0 -61.39 -36.23 79.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.249 177.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -81.08 -16.12 54.05 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.047 0.451 . . . . 0.0 110.014 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 1.053 HD23 ' HG2' ' B' ' 65' ' ' GLU . 0.0 OUTLIER -79.17 -27.12 42.64 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.336 179.941 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 1.053 ' HG2' HD23 ' B' ' 64' ' ' LEU . 7.6 mm-40 -102.84 -21.66 13.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.109 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -64.63 -36.16 83.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.944 0.402 . . . . 0.0 110.065 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -83.04 -0.45 49.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.799 179.307 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' B' ' 67' ' ' LEU . 72.9 m-85 67.41 -96.42 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.107 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.589 ' O ' HD23 ' B' ' 69' ' ' LEU . 1.6 tt 47.06 27.98 0.84 Allowed 'General case' 0 CA--C 1.528 0.103 0 CA-C-O 120.71 0.291 . . . . 0.0 111.272 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 98.1 mt -154.81 -45.8 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.152 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.846 HD13 ' O ' ' B' ' 71' ' ' ILE . 0.0 OUTLIER -59.63 -31.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.083 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . 0.473 ' O ' ' CG ' ' B' ' 72' ' ' PHE . 10.6 p90 -123.25 74.46 50.56 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-O 120.963 0.411 . . . . 0.0 110.851 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -87.53 16.54 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.905 2.403 . . . . 0.0 112.898 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.68 -58.15 2.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.841 0.353 . . . . 0.0 110.941 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 59.07 29.91 19.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 -158.4 -50.61 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.776 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 15.4 mt -120.15 -177.82 3.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.822 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.741 ' CG ' HD23 ' B' ' 81' ' ' LEU . 3.0 m-20 -135.61 93.28 2.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.631 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 22.9 ptp -66.37 -38.86 88.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.928 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 1.077 HG22 HD11 ' A' ' 81' ' ' LEU . 42.5 mm -73.56 -43.2 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 1.063 HD11 HG22 ' A' ' 80' ' ' ILE . 1.7 mm? -74.17 -22.29 59.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.264 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -90.37 -27.68 19.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.867 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -23.98 25.08 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.998 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . 0.577 ' HB2' HD12 ' A' ' 81' ' ' LEU . 12.7 m-20 -103.86 104.26 14.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.959 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . 0.556 ' HB3' HD11 ' A' ' 86' ' ' LEU . 58.4 m 60.71 112.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.866 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.477 HD21 ' HB3' ' A' ' 85' ' ' SER . 0.1 OUTLIER -177.45 -39.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.952 -179.945 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.23 -24.93 17.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.134 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.758 ' O ' HD23 ' B' ' 92' ' ' LEU . 1.0 OUTLIER -70.19 -10.15 57.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.391 179.875 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.549 ' HB ' HG21 ' A' ' 89' ' ' ILE . 17.1 mm -90.8 -56.73 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.59 ' O ' ' HB ' ' B' ' 94' ' ' THR . 1.4 tt0 -62.7 -20.19 64.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.263 177.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . 0.722 ' HA ' HG22 ' B' ' 94' ' ' THR . . . -87.05 -56.09 3.53 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.201 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.758 HD23 ' O ' ' B' ' 88' ' ' ASP . 3.1 mm? -51.72 -26.15 8.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.891 ' HB3' HD13 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -90.6 -38.58 13.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.676 179.408 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.722 HG22 ' HA ' ' B' ' 91' ' ' ALA . 2.1 t -67.2 -11.34 57.13 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.075 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -121.31 -28.44 1.64 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.552 -0.833 . . . . 0.0 113.053 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.446 ' O ' HD23 ' B' ' 96' ' ' LEU . 0.4 OUTLIER -103.0 2.37 34.86 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -179.546 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' B' ' 93' ' ' LEU . 29.2 p90 -41.14 137.77 1.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.561 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 11.3 p -83.71 145.43 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.093 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -145.41 99.02 3.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.922 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -147.39 -47.02 0.17 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -107.83 128.68 54.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.918 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 35.5 m -119.26 -39.39 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.222 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -106.74 37.62 2.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.864 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.55 162.9 37.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.913 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -106.28 133.41 51.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.896 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.163 179.99 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.865 0.365 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.88 -177.13 3.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.814 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 66.13 131.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.86 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' B' ' 53' ' ' HIS . 2.5 m-70 -92.52 127.4 38.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.165 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.702 HD12 HG13 ' B' ' 57' ' ' VAL . 6.3 tp -174.11 -90.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.003 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.57 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 97.6 m 3.02 -100.29 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.557 ' N ' HG22 ' A' ' 55' ' ' THR . 4.8 tp10 -35.97 -69.92 0.1 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.717 HG13 HD12 ' B' ' 54' ' ' LEU . 5.1 t -46.66 -29.93 1.23 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.553 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.63 ' O ' ' HG ' ' B' ' 61' ' ' LEU . 1.4 pt-20 -66.88 -48.25 69.33 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 2.1 m -65.86 -14.63 61.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.201 177.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.431 ' HB2' ' HA ' ' A' ' 57' ' ' VAL . 0.0 OUTLIER -77.03 -75.95 0.19 Allowed 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.835 -179.725 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 1.05 HD13 HD21 ' A' ' 64' ' ' LEU . 3.9 mm? -60.36 -25.3 65.75 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.803 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.556 ' HB2' HD12 ' B' ' 61' ' ' LEU . 11.4 tt0 -73.13 -37.08 66.78 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 59' ' ' SER . 2.0 mmt180 -58.82 -39.99 82.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.488 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 1.05 HD21 HD13 ' A' ' 61' ' ' LEU . 1.2 pp -78.46 -23.28 46.6 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.238 178.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.51 ' HB3' ' HA ' ' A' ' 62' ' ' GLU . 1.2 tp10 -65.68 -34.56 78.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.475 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -28.18 62.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.422 179.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.454 ' C ' ' CG ' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -92.68 -0.36 57.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.256 179.849 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.454 ' CG ' ' C ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER 47.13 -88.81 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.592 179.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 67' ' ' LEU . 3.6 tp 64.26 24.69 13.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.684 0.278 . . . . 0.0 110.894 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.5 mt -148.79 -48.55 0.15 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.551 ' H ' HD12 ' A' ' 71' ' ' ILE . 3.8 mp -82.82 -34.22 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.185 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.83 92.52 4.4 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.98 -170.37 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.471 2.114 . . . . 0.0 112.34 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -145.82 85.07 1.68 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.251 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.13 164.49 14.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.585 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.56 49.61 1.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.732 HD13 ' H ' ' A' ' 78' ' ' ASP . 0.2 OUTLIER -179.73 148.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.009 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.732 ' H ' HD13 ' A' ' 77' ' ' LEU . 1.2 p30 -86.97 79.8 8.63 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -50.65 -28.01 8.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.25 -179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.815 HG22 HD21 ' B' ' 81' ' ' LEU . 21.0 mt -76.7 -60.3 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.953 0.406 . . . . 0.0 110.732 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 1.07 HD22 HD22 ' B' ' 81' ' ' LEU . 2.3 mm? -54.68 -19.56 6.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.764 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.55 -25.11 13.33 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.1 mmm -98.94 -2.01 38.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.51 87.98 2.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.389 -179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.06 -156.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.733 HD12 ' HB3' ' B' ' 86' ' ' LEU . 4.3 mm? 63.26 29.63 15.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.835 0.35 . . . . 0.0 110.936 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.15 -42.33 1.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.608 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' A' ' 92' ' ' LEU . 17.4 t70 -70.71 -9.54 57.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.051 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.676 HD12 ' N ' ' A' ' 89' ' ' ILE . 2.6 mp -88.66 -56.09 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.594 ' HG3' HG21 ' B' ' 89' ' ' ILE . 0.1 OUTLIER -63.41 -19.97 65.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.259 177.869 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.9 -63.74 1.27 Allowed 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.65 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.547 HD23 ' HB2' ' A' ' 96' ' ' LEU . 1.2 tt -51.54 -24.41 5.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.947 0.403 . . . . 0.0 110.431 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.499 ' HB3' HD12 ' B' ' 93' ' ' LEU . 3.8 mm? -90.12 -40.99 11.91 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.485 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.79 -13.63 59.81 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.167 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.28 -50.23 0.31 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.228 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.612 HD22 ' N ' ' A' ' 96' ' ' LEU . 2.6 mm? -98.12 -2.48 39.91 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.24 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.92 32.96 0.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.834 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.566 HG11 ' HB2' ' A' ' 101' ' ' ASN . 18.3 t -76.59 130.84 35.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.931 0.396 . . . . 0.0 111.266 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.6 mm100 -65.7 -62.63 1.4 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.071 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -137.78 -44.82 0.53 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.128 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.566 ' HB2' HG11 ' A' ' 98' ' ' VAL . 2.1 t30 69.54 107.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.904 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.561 HG13 ' O ' ' A' ' 102' ' ' VAL . 11.0 p -129.41 113.1 26.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.048 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -143.11 -53.9 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.951 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.5 ptpp? -173.71 -43.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.898 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -94.55 153.77 17.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.921 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.051 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.778 0.323 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.43 ' O ' ' HB3' ' B' ' 52' ' ' ALA . 0.0 OUTLIER -148.18 -165.07 2.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.861 179.967 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' B' ' 51' ' ' ARG . . . 69.05 131.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.851 0.358 . . . . 0.0 111.102 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 53' ' ' HIS . 2.5 m-70 -92.74 127.43 38.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.075 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.717 HD12 HG13 ' A' ' 57' ' ' VAL . 6.3 tp -174.08 -90.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.031 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.578 ' O ' ' HG2' ' B' ' 58' ' ' GLU . 98.8 m 3.17 -100.37 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.559 ' N ' HG22 ' B' ' 55' ' ' THR . 4.8 tp10 -35.7 -70.15 0.09 Allowed 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.702 HG13 HD12 ' A' ' 54' ' ' LEU . 5.3 t -46.68 -30.06 1.26 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.571 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.404 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.636 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 1.4 pt-20 -66.71 -48.34 69.54 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' B' ' 63' ' ' ARG . 2.1 m -65.73 -14.62 61.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.288 177.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.425 ' HB2' ' HA ' ' B' ' 57' ' ' VAL . 0.0 OUTLIER -77.02 -75.97 0.19 Allowed 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.798 -179.603 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 1.039 HD13 HD21 ' B' ' 64' ' ' LEU . 3.9 mm? -60.39 -25.31 65.81 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 119.74 -0.784 . . . . 0.0 109.793 -179.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.575 ' HB2' HD12 ' A' ' 61' ' ' LEU . 11.3 tt0 -73.05 -37.18 66.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' B' ' 59' ' ' SER . 1.9 mmt180 -58.89 -39.9 82.8 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.542 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 1.039 HD21 HD13 ' B' ' 61' ' ' LEU . 1.2 pp -78.44 -23.33 46.66 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.272 178.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.493 ' HB3' ' HA ' ' B' ' 62' ' ' GLU . 1.1 tp10 -65.64 -34.58 78.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.479 178.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.57 -28.18 62.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.402 179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.444 ' C ' ' CG ' ' B' ' 68' ' ' PHE . 0.2 OUTLIER -92.65 -0.23 57.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.266 179.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' B' ' 68' ' ' PHE . 0.1 OUTLIER 46.96 -88.79 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.504 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.442 ' N ' ' O ' ' B' ' 67' ' ' LEU . 0.2 OUTLIER 64.19 24.81 13.5 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.694 0.283 . . . . 0.0 110.943 -179.849 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 mt -148.86 -48.65 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.91 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' ILE . . . . . 0.547 ' H ' HD12 ' B' ' 71' ' ' ILE . 3.8 mp -82.86 -34.0 11.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.26 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -103.95 92.47 4.46 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -68.9 -170.36 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.46 2.107 . . . . 0.0 112.411 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -146.76 81.04 1.55 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.543 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.402 ' O ' ' N ' ' B' ' 77' ' ' LEU . 3.6 mt-10 -119.96 12.79 12.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.638 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 66.12 -73.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.752 0.311 . . . . 0.0 110.889 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' B' ' 75' ' ' GLU . 0.5 OUTLIER -49.48 149.4 2.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.902 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' ASP . . . . . 0.508 ' HB2' ' HB2' ' B' ' 81' ' ' LEU . 1.4 p30 -93.42 79.52 4.39 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.096 0.474 . . . . 0.0 111.464 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 3.3 ptt? -51.33 -27.79 10.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.062 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.799 HG22 ' CD2' ' A' ' 81' ' ' LEU . 20.9 mt -76.69 -60.24 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.95 0.405 . . . . 0.0 110.755 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 1.07 HD22 HD22 ' A' ' 81' ' ' LEU . 2.3 mm? -54.75 -19.59 6.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.701 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -103.41 -25.22 13.35 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . 8.2 mmm -98.87 -2.04 38.69 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -178.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -119.42 88.02 2.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.03 -156.74 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.053 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.832 HD22 ' CD1' ' A' ' 81' ' ' LEU . 5.9 mp 63.28 29.54 15.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.904 0.383 . . . . 0.0 110.972 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -128.25 -42.48 1.51 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.732 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' B' ' 92' ' ' LEU . 17.4 t70 -70.65 -9.46 57.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.052 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.668 HD12 ' N ' ' B' ' 89' ' ' ILE . 2.6 mp -88.67 -55.98 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.416 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.59 ' HG3' HG21 ' A' ' 89' ' ' ILE . 0.1 OUTLIER -63.35 -20.04 65.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.338 177.752 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.93 -63.72 1.27 Allowed 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.614 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' LEU . . . . . 0.541 HD23 ' HB2' ' B' ' 96' ' ' LEU . 1.2 tt -51.52 -24.38 5.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.918 0.389 . . . . 0.0 110.433 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.499 HD12 ' HB3' ' A' ' 93' ' ' LEU . 3.9 mm? -90.21 -40.96 11.87 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.403 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 3.3 m -65.84 -13.53 59.71 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.223 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -119.32 -50.2 0.31 Allowed Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.457 -0.878 . . . . 0.0 113.182 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.602 HD22 ' N ' ' B' ' 96' ' ' LEU . 2.6 mm? -98.18 -2.62 39.42 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 35.1 p90 39.95 33.1 0.13 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.788 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.551 HG11 ' HB2' ' B' ' 101' ' ' ASN . 18.6 t -76.69 130.87 35.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.227 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 8.6 mm100 -65.72 -62.71 1.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.956 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -137.84 -44.81 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' ASN . . . . . 0.551 ' HB2' HG11 ' B' ' 98' ' ' VAL . 2.1 t30 69.55 107.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.829 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.562 ' O ' HG13 ' B' ' 102' ' ' VAL . 11.0 p -129.33 113.0 26.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.106 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -143.11 -53.83 0.39 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.8 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -173.75 -44.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.902 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -94.4 153.76 17.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.865 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.173 -0.918 . . . . 0.0 111.194 179.92 . . . . . . . . 0 0 . 1 stop_ save_