data_1p9z_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 1p9z _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 ' 2' ' ' THR . . . . . . . . . . . . . 63.4 p . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.863 0.363 . . . . 2.21 110.866 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -67.99 -50.75 53.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.76 110.973 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -29.84 59.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 1.5 111.227 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -26.61 64.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 1.74 111.034 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -102.79 26.67 7.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 4.0199999999999996 111.079 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -83.92 162.17 53.18 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.417 . . . . 1.1899999999999999 110.794 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -81.79 0.87 48.11 Favored 'Cis proline' 0 C--N 1.346 0.413 0 C-N-CA 123.383 -1.507 . . . . 0.94999999999999996 112.857 0.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.99 70.0 3.71 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 120.773 0.32 . . . . 4.0800000000000001 111.009 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.79 -44.23 0.38 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.616 2.211 . . . . 0.81999999999999995 112.407 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 97.0 m -113.1 -178.25 3.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 1.3200000000000001 110.973 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.9 -172.81 2.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 2.0899999999999999 110.86 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.87 140.22 36.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 1.3799999999999999 111.06 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.85 -28.18 12.88 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.792 -0.718 . . . . 0.56999999999999995 112.448 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -106.48 158.59 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.825 0.345 . . . . 1.4299999999999999 110.82 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.3 m -128.03 150.6 49.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.56999999999999995 110.929 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -87.38 126.39 34.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 1.03 110.862 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.3 t -92.46 137.32 32.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 1.72 110.865 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.4 pt -47.42 -31.34 2.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 1.4199999999999999 111.568 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -58.13 -21.85 48.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 3.0 110.978 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 22' ' ' TYR . . . 104.92 39.18 2.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.722 -0.751 . . . . 0.58999999999999997 112.369 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 21' ' ' GLY . 74.8 m-85 -159.41 143.33 14.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.872 0.368 . . . . 2.4100000000000001 111.05 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.9 m -78.11 179.84 6.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 1.0700000000000001 110.814 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.425 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 160.57 -145.6 11.33 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.676 -0.773 . . . . 0.48999999999999999 112.57 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.91 -170.5 3.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.841 0.353 . . . . 1.9199999999999999 110.958 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.61 -160.52 28.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.58999999999999997 112.554 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.63 -28.76 28.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 1.24 111.202 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.23 -35.04 72.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 1.1699999999999999 111.167 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.425 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 97.7 m-85 -112.77 -33.15 6.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.228 -0.442 . . . . 2.23 111.066 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -115.21 44.47 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 1.24 110.909 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -103.34 162.48 15.9 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.713 -0.755 . . . . 1.0800000000000001 112.526 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.5 103.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.81 0.338 . . . . 1.8400000000000001 111.122 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.59 -23.19 32.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.694 -0.765 . . . . 1.3500000000000001 112.619 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -103.58 27.15 7.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.731 0.301 . . . . 1.48 110.968 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.6 p -137.41 124.27 21.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.357 -0.383 . . . . 1.3500000000000001 110.962 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -79.87 -37.84 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 2.6800000000000002 110.872 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 m -146.52 167.69 23.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 1.05 110.942 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 61.84 46.11 7.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.8700000000000001 110.738 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.5 m . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.991 -0.549 . . . . 1.29 110.882 179.957 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.944 0.402 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.9 p -69.88 -21.53 63.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.2 -31.67 65.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.839 0.352 . . . . 0.0 111.305 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.4 t -67.69 -19.4 65.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.455 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -112.34 31.57 6.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 111.283 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 m -69.01 162.22 66.72 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -91.63 8.77 62.54 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.845 -1.314 . . . . 0.0 112.909 0.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 -135.01 66.91 69.23 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.0 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -83.36 -42.87 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.733 2.289 . . . . 0.0 112.483 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.75 179.22 7.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.952 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.33 -171.6 3.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.801 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.11 134.04 35.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.047 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.68 -26.07 23.67 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.474 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -112.14 140.08 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.83 0.348 . . . . 0.0 110.892 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.0 m -108.85 166.82 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.768 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 3.8 m -102.55 124.45 48.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.985 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.1 t -83.97 143.49 29.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.455 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.3 pp -47.8 -27.67 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.061 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -71.79 -5.91 37.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.541 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.86 6.35 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -133.73 179.37 6.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.855 0.36 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.71 148.83 51.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.792 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.87 -137.06 2.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.616 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.9 t -155.34 -169.0 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.984 0.421 . . . . 0.0 110.975 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.83 -171.97 25.47 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.509 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.62 -9.88 59.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.559 0.219 . . . . 0.0 111.523 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.95 -37.0 56.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.8 0.333 . . . . 0.0 111.207 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -110.39 -27.4 9.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.112 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.3 m -111.37 29.92 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.989 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -108.01 159.27 14.46 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.517 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.15 119.98 16.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.123 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.2 -28.19 11.44 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -107.5 -27.91 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.787 0.327 . . . . 0.0 110.973 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 45.5 t -85.58 105.9 16.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.455 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 7.6 ttp180 -79.99 -47.8 14.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.264 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.23 160.95 33.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 111.268 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? 62.31 46.17 6.18 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.821 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 m . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.855 179.958 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.871 0.367 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.8 p -84.13 2.68 38.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.505 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.24 -30.35 68.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.786 0.327 . . . . 0.0 111.145 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 p -68.61 -22.05 64.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.317 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.15 29.93 6.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.798 0.332 . . . . 0.0 110.995 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.416 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.24 164.27 53.1 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.823 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 6.5 Cg_endo -87.52 4.06 69.21 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 124.064 -1.223 . . . . 0.0 112.859 0.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -127.64 69.54 75.88 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 120.924 0.392 . . . . 0.0 110.907 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -81.03 -43.2 0.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.622 2.215 . . . . 0.0 112.396 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 51.5 m -85.74 162.14 18.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -63.93 -173.59 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.13 134.3 36.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.075 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 105.83 -26.17 21.81 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.498 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mp -105.17 169.32 8.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.33 . . . . 0.0 110.885 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 m -146.21 150.25 35.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -87.26 126.16 34.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.29 142.64 30.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.066 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.415 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.3 pt -47.17 -32.01 2.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.828 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -61.75 -18.41 59.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.083 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.81 40.21 2.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.064 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -139.38 -176.58 4.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 110.94 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.4 t -132.5 155.59 48.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.406 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 173.91 -132.28 2.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.547 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.07 -172.01 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.857 0.36 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.41 -160.21 46.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.46 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.91 -29.55 29.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.784 0.326 . . . . 0.0 111.099 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.05 79.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.227 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.406 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 70.9 m-85 -108.18 -29.73 8.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.007 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 2.0 t -120.38 39.53 3.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.098 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.62 171.79 53.01 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.352 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.46 65.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.897 0.38 . . . . 0.0 111.038 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.14 28.54 7.21 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.345 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -148.78 28.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.789 0.328 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.1 p -124.6 123.14 39.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.2 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.415 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.5 tpp180 -79.93 -41.8 25.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.48 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 m -151.61 161.23 43.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.45 46.43 5.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.021 0.439 . . . . 0.0 110.617 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 59.9 m . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.913 179.894 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.878 0.37 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.1 p -65.54 -25.45 67.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.038 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.72 -35.32 74.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.5 m -64.59 -15.9 61.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.734 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -123.34 37.94 4.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.669 0.271 . . . . 0.0 111.374 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.9 m -74.17 160.05 82.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.767 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -89.65 6.83 68.34 Favored 'Cis proline' 0 N--CA 1.46 -0.482 0 C-N-CA 123.576 -1.426 . . . . 0.0 112.753 0.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 77.52 62.24 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.51 -30.29 2.55 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.603 2.202 . . . . 0.0 112.616 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.1 m -115.08 175.28 5.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.053 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -63.45 -170.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.923 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 133.6 36.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.76 -26.35 18.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.44 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.93 165.11 14.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.801 0.334 . . . . 0.0 110.835 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.6 m -143.07 149.66 38.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.11 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.1 t -90.37 109.04 20.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.527 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.4 p -74.44 140.03 44.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.108 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.485 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.0 pp -46.98 -34.36 2.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.87 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -59.64 -19.4 48.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.067 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.21 41.02 2.68 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.044 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -137.27 173.98 11.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.9 0.381 . . . . 0.0 111.02 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.25 129.03 49.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.841 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.427 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -162.62 -145.17 4.25 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.483 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -142.79 -172.98 3.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.81 -162.43 11.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.464 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.73 -26.2 54.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.77 0.319 . . . . 0.0 111.26 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.53 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.342 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.427 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.0 m-85 -127.43 5.57 6.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -150.65 30.52 0.66 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.878 0.37 . . . . 0.0 110.924 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.07 -171.6 47.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.544 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -76.83 -32.23 57.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.67 16.63 12.39 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.667 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -141.73 33.83 1.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.786 0.327 . . . . 0.0 110.75 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.9 t -136.22 104.33 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.198 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.485 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.5 OUTLIER -79.92 -52.58 7.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.719 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.48 164.2 21.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 61.37 45.86 8.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.3 m . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.925 -179.992 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.792 0.33 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.56 -48.52 74.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.11 -37.6 85.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.125 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 m -68.78 -28.73 67.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.063 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.61 28.06 7.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.018 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.402 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 3.4 m -90.0 162.63 34.8 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.851 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 80.6 Cg_endo -89.21 17.31 41.46 Favored 'Cis proline' 0 C--N 1.347 0.466 0 C-N-CA 123.66 -1.392 . . . . 0.0 112.893 0.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -129.32 63.4 67.39 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.922 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -82.84 -43.01 0.09 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.693 2.262 . . . . 0.0 112.357 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.2 m -94.62 163.68 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -74.05 -173.33 1.58 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.08 133.37 36.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.08 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 -25.68 25.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.54 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -109.49 137.46 47.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.355 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 74.6 m -107.73 151.09 26.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.1 119.6 33.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.046 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.419 ' HB2' ' CD2' ' A' ' 29' ' ' TYR . 0.4 OUTLIER -77.98 146.18 35.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.702 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.435 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.9 pt -44.58 -30.18 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.033 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.401 ' N ' HG13 ' A' ' 19' ' ' ILE . 2.8 m-85 -59.91 -18.98 49.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.957 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.21 41.96 3.35 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.044 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -150.56 144.35 25.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.928 0.394 . . . . 0.0 111.404 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 m -79.67 158.2 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.917 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.425 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . -178.89 -139.36 3.53 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.563 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.01 -170.93 3.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 0.0 110.97 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.34 -166.71 10.85 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.542 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.18 -27.34 47.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.795 0.331 . . . . 0.0 111.184 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.14 73.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.128 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.425 ' CD2' ' HA3' ' A' ' 24' ' ' GLY . 10.8 m-85 -109.54 -27.4 9.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.004 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.4 t -122.18 48.29 1.76 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -122.54 159.22 17.19 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.498 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.15 116.48 3.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.791 0.329 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.19 -16.69 45.4 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.662 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 50.8 m-20 -132.11 44.12 2.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.881 0.372 . . . . 0.0 110.843 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.1 t -127.2 105.8 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.107 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.435 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -79.79 -57.53 3.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.792 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.5 m -143.88 169.5 17.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.876 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 61.86 46.16 7.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.993 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.837 0.351 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.5 p -62.41 -30.91 71.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.04 -39.19 74.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.297 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 t -70.32 -21.04 62.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.215 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -97.24 23.07 7.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.148 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.5 m -70.52 161.09 78.92 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.832 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -84.71 1.37 62.02 Favored 'Cis proline' 0 C--N 1.347 0.469 0 C-N-CA 123.475 -1.469 . . . . 0.0 112.862 0.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -126.5 76.75 73.66 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.768 0.318 . . . . 0.0 110.967 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.98 -66.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.746 2.298 . . . . 0.0 112.337 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.1 m -95.95 179.77 4.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.039 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.39 -170.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.952 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.96 137.03 36.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.005 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.14 -28.23 12.46 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.446 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.04 169.81 9.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.8 0.333 . . . . 0.0 110.853 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 m -141.97 150.35 41.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 43.1 t -98.22 108.22 20.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.25 137.52 46.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.448 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.0 pt -46.11 -33.19 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.903 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.54 -20.31 45.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.019 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 101.18 41.91 2.5 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.142 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 6.5 m-85 -148.01 146.49 28.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 111.171 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -91.65 152.77 20.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.773 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.27 -144.62 5.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.577 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.0 t -157.45 -169.87 3.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.834 0.349 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.35 -167.56 18.17 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.511 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.62 -12.25 60.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.686 0.279 . . . . 0.0 111.525 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.75 -34.31 66.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.791 0.329 . . . . 0.0 111.194 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -116.74 -21.02 9.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.515 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 -12.16 14.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.669 -0.242 . . . . 0.0 111.477 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.7 162.85 44.57 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.497 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.58 149.86 49.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.834 0.349 . . . . 0.0 111.121 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.29 24.15 58.62 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.527 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -160.06 39.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.9 p -159.97 120.29 2.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.078 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.448 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 9.5 ttm180 -79.82 -56.92 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.3 m -123.85 165.81 16.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.42 46.97 4.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.862 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.921 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.3 p . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.823 0.344 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.2 t -74.66 -43.69 54.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.2 -40.32 97.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.131 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.1 m -70.16 -23.85 63.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.275 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -98.07 23.66 7.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.115 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 8' ' ' PRO . 23.3 m -78.89 161.52 68.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.636 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.431 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 71.0 Cg_endo -87.46 4.34 69.15 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.706 -1.372 . . . . 0.0 112.987 0.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.32 73.67 67.47 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 0.0 111.085 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.85 -42.97 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.565 2.177 . . . . 0.0 112.243 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.9 m -114.03 176.9 4.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.971 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.48 -174.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.969 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 146.76 31.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.93 -25.18 28.27 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.47 154.23 20.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.816 0.341 . . . . 0.0 110.905 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.9 m -120.03 150.56 40.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.963 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.4 t -84.56 113.7 21.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.998 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.44 137.64 37.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.759 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 29.5 pt -45.72 -37.0 2.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.824 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -56.54 -22.43 33.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.965 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 103.93 41.04 2.19 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.184 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.408 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 20.7 m-85 -153.67 143.03 21.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.817 0.342 . . . . 0.0 111.149 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.52 169.44 18.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.435 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 168.07 -150.42 16.4 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.417 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -152.44 -169.49 3.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.935 0.398 . . . . 0.0 111.004 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.19 -160.2 35.76 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.5 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.78 -30.6 26.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.859 0.361 . . . . 0.0 111.16 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -35.62 72.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.435 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 53.2 m-85 -110.63 -28.5 8.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.042 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 47.55 2.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 110.952 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -104.02 165.27 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.436 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.28 92.59 1.04 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 111.102 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.0 16.03 14.76 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.651 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -137.05 12.8 3.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.607 0.241 . . . . 0.0 111.232 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.3 p -127.43 137.98 52.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 110.864 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.97 -53.52 6.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.945 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 p -149.55 169.03 21.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.52 47.73 2.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.792 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.6 m . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.953 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.917 0.389 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 t -64.88 -47.64 77.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.974 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.41 86.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.128 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -22.75 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.093 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 28.32 7.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.806 0.336 . . . . 0.0 111.059 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.406 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.77 162.88 58.6 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.778 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 81.2 Cg_endo -89.62 14.12 51.11 Favored 'Cis proline' 0 C--N 1.347 0.497 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.819 0.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.28 63.42 67.39 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.808 0.337 . . . . 0.0 110.972 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -84.12 -44.06 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.726 2.284 . . . . 0.0 112.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.3 m -82.08 154.6 25.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.898 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.4 -170.85 0.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.832 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.84 120.29 24.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.99 -12.27 17.39 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.765 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -134.35 139.57 45.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -92.94 -178.1 4.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.0 t -113.51 123.22 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.789 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.2 p -83.93 145.8 28.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.402 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.501 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.8 pt -46.66 -27.18 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.105 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.085 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -75.0 0.65 15.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.607 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.96 37.59 18.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.017 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -129.6 178.41 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 111.053 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.403 ' O ' ' CE1' ' A' ' 29' ' ' TYR . 71.1 m -126.79 157.86 38.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.85 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.417 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 169.84 -147.89 11.31 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.623 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.16 -168.01 2.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.967 0.413 . . . . 0.0 111.046 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.35 -165.79 26.82 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.521 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 -27.48 54.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.789 0.328 . . . . 0.0 111.112 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.51 75.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.417 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 88.0 m-85 -107.58 -30.19 8.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.109 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.4 m -115.09 38.92 3.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.987 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.49 -166.99 40.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.439 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.38 -35.7 14.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.893 0.378 . . . . 0.0 111.155 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.67 23.46 29.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.494 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -153.98 43.96 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 7.6 t -125.54 102.79 7.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.041 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.501 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 2.9 tpt180 -79.84 -46.25 17.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.825 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.3 m -150.1 168.38 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 62.48 46.15 5.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.813 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.7 m . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.927 179.972 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.8 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.909 0.385 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 t -86.35 -49.07 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.968 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.91 71.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.191 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.6 -27.43 66.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.065 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.95 28.99 7.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.972 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -89.97 163.03 33.71 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.741 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -87.81 4.84 69.33 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.655 -1.394 . . . . 0.0 112.907 0.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -120.84 66.9 14.28 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.362 . . . . 0.0 111.113 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -77.58 -43.33 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.58 2.187 . . . . 0.0 112.481 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.0 m -105.87 171.7 7.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.06 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.9 -170.02 2.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.935 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.92 134.04 36.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.011 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.07 -26.79 9.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.367 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -114.63 147.38 39.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.869 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -119.95 146.35 45.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.858 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.5 t -85.13 119.18 25.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.744 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.8 t -77.76 145.27 36.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.4 pt -46.79 -26.01 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.104 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.45 9.74 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.532 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.8 44.76 37.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.621 -0.8 . . . . 0.0 112.278 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -145.52 122.17 11.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.809 0.338 . . . . 0.0 111.205 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -73.3 170.04 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.775 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 158.66 -152.7 23.83 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.596 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.5 p -145.11 -168.21 2.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.391 . . . . 0.0 111.06 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.33 -169.94 42.87 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.39 -16.35 58.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.682 0.277 . . . . 0.0 111.435 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.03 -34.02 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.759 0.314 . . . . 0.0 111.309 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CD2' ' HA3' ' A' ' 24' ' ' GLY . 74.1 m-85 -107.96 -33.66 7.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.204 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.7 m -108.71 28.2 8.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.044 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -79.73 -174.84 47.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.557 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.35 -33.01 16.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.35 . . . . 0.0 111.066 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.55 19.66 44.34 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.602 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -152.79 48.45 0.73 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.362 . . . . 0.0 110.726 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.3 t -126.35 103.32 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -79.89 -54.79 5.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.7 m -138.56 170.31 16.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.943 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.39 47.37 3.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.0 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.894 0.378 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.449 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 19.4 p -79.67 -21.03 45.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.186 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.87 -26.38 24.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.728 0.299 . . . . 0.0 111.389 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.6 p -74.24 -14.48 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.523 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -96.02 9.62 40.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.573 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.27 144.16 83.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.428 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -95.78 26.85 19.38 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.315 -1.119 . . . . 0.0 112.968 0.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.455 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 11.8 mtm-85 -130.82 53.4 11.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.662 0.268 . . . . 0.0 111.355 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.455 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 95.6 Cg_endo -84.9 -43.59 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.573 2.182 . . . . 0.0 112.714 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 t -100.0 170.75 8.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.107 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -81.8 -174.63 5.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.02 129.37 34.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.096 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.7 -22.41 37.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.616 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.6 166.52 11.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 110.981 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -132.98 155.04 49.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.765 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.63 103.69 16.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.844 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.49 140.56 56.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.001 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pp -45.87 -39.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.806 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -56.61 -22.41 33.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.988 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.89 45.93 1.44 Allowed Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.119 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -152.77 133.03 13.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.158 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.25 162.18 28.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.843 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 168.52 -159.44 32.6 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.53 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -144.81 -177.37 5.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.796 0.332 . . . . 0.0 110.846 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.62 -169.87 8.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.3 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.51 -15.88 61.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.61 0.243 . . . . 0.0 111.371 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.57 78.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.717 0.294 . . . . 0.0 111.414 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -133.37 17.0 4.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.4 t -160.08 30.2 0.17 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.05 176.93 32.26 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.502 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.12 109.28 2.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.823 0.344 . . . . 0.0 111.075 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.23 -23.06 37.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.617 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -107.94 29.93 6.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.813 0.34 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.7 t -129.04 118.22 22.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.02 -64.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.966 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 80.6 m -127.4 163.84 23.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.872 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.4 46.68 4.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.82 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 m . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.938 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.954 0.407 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -73.64 -40.89 63.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.33 -32.63 74.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.145 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 -26.44 65.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.037 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 mtp180 -106.22 28.98 7.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.958 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.427 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.3 m -85.03 164.7 40.53 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 79.0 Cg_endo -86.67 2.84 68.1 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.65 -1.396 . . . . 0.0 112.915 0.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -124.34 68.96 50.49 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.98 -27.28 2.55 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.617 2.211 . . . . 0.0 112.579 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -109.2 171.72 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.072 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -71.58 -174.22 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 133.46 36.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.97 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.82 -26.82 11.08 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.336 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.8 170.29 7.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.749 0.309 . . . . 0.0 110.803 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.2 m -141.62 161.33 38.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.933 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.7 t -93.72 132.74 37.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.088 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -93.68 138.4 31.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.891 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.2 pp -45.69 -38.12 2.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.819 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -57.0 -22.16 36.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.074 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.05 41.41 2.11 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.072 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -154.27 141.01 19.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.854 0.359 . . . . 0.0 111.034 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -74.18 175.57 7.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.899 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.2 -146.65 11.68 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.427 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 m -155.49 -170.89 3.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.886 0.374 . . . . 0.0 110.967 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.16 -160.91 42.16 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.441 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.58 -29.93 25.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.737 0.303 . . . . 0.0 111.087 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.15 -36.31 79.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.208 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.419 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 79.2 m-85 -108.12 -29.77 8.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.008 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 5.0 t -126.33 48.83 2.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.96 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.64 -146.34 19.69 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.411 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -119.98 76.16 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 111.038 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.05 -27.94 3.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.401 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -98.08 21.74 10.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.675 0.274 . . . . 0.0 111.042 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 19.6 p -120.22 135.31 55.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.35 . . . . 0.0 110.913 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.97 -39.94 29.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.866 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.8 m -148.75 166.12 29.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.28 46.75 2.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.8 m . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.963 179.862 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.9 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.922 0.391 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.7 t -78.51 -32.73 48.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.903 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.21 86.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.058 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -70.26 -22.71 62.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.02 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.1 mtp180 -79.92 -21.47 43.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.134 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.415 ' HB3' ' HA ' ' A' ' 8' ' ' PRO . 51.2 m -52.68 160.24 1.47 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.951 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.415 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 63.1 Cg_endo -90.35 18.75 38.3 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.897 0.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.18 66.32 45.28 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.748 0.309 . . . . 0.0 111.231 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -71.85 -42.73 1.51 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.771 2.314 . . . . 0.0 112.261 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.8 m -122.15 172.17 8.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.103 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 140.03 36.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.045 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.28 -27.95 14.17 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.432 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.78 171.77 8.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.813 0.34 . . . . 0.0 110.916 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.6 m -146.89 159.37 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.836 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.2 t -98.33 127.28 44.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 t -88.91 139.34 30.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 21.1 pt -46.01 -36.72 2.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.823 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -19.66 29.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.083 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.77 46.53 1.92 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.112 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -154.13 142.99 21.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.915 0.388 . . . . 0.0 111.283 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.4 ' O ' ' CD2' ' A' ' 29' ' ' TYR . 0.5 OUTLIER -81.59 170.66 15.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.797 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.438 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 159.81 -150.27 20.45 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.578 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.1 t -148.42 -170.06 3.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.912 0.386 . . . . 0.0 110.994 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.39 -157.14 37.42 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.516 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.48 -26.76 29.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 0.0 111.194 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.26 75.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.17 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.438 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 34.2 m-85 -116.56 -17.96 10.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.447 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -129.81 32.25 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.761 0.315 . . . . 0.0 110.958 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.15 177.52 39.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.506 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.67 132.12 42.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.86 0.362 . . . . 0.0 111.14 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.19 24.56 58.88 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.468 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -143.28 23.48 1.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 111.134 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.2 p -131.36 125.73 33.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.015 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -43.95 21.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.974 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -136.34 167.66 20.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.961 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 61.64 45.82 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.793 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.1 m . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.875 179.917 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.2 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.007 0.432 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.8 m -49.38 -54.73 15.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.231 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -52.8 -41.71 64.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.241 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.8 t -67.26 -27.39 67.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.032 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.3 mtm105 -118.41 30.07 7.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.04 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.422 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.6 m -84.98 164.2 42.75 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.726 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 72.6 Cg_endo -89.83 19.98 33.94 Favored 'Cis proline' 0 C--N 1.347 0.495 0 C-N-CA 123.791 -1.337 . . . . 0.0 112.936 0.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.413 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 31.8 mtp180 -137.59 64.82 45.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.701 0.286 . . . . 0.0 111.199 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.413 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 17.3 Cg_exo -67.1 -51.66 0.75 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.585 2.19 . . . . 0.0 112.104 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.03 -177.06 4.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -72.43 -174.99 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 139.96 35.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.113 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.72 -25.25 28.14 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.448 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -108.36 144.06 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.831 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.3 m -108.58 139.78 42.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.744 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.88 106.37 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.8 p -66.24 140.82 58.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.034 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.42 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.3 pp -48.12 -33.71 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.655 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -56.71 -22.87 38.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.032 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.27 41.44 1.78 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.38 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -158.81 134.51 8.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.838 0.351 . . . . 0.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.67 152.12 20.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 29' ' ' TYR . . . -174.43 -136.37 2.23 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.484 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -147.92 -169.9 3.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.915 0.388 . . . . 0.0 110.919 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 -161.38 45.59 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.499 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.25 -25.87 36.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.771 0.32 . . . . 0.0 111.219 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.31 80.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.239 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.436 ' CD2' ' N ' ' A' ' 24' ' ' GLY . 54.3 m-85 -108.91 -37.97 5.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.073 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 77.8 m -114.04 47.97 1.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.949 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.67 -155.75 30.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.478 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.7 115.32 29.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.856 0.36 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.06 10.7 86.03 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.764 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 39.7 m-20 -113.33 -29.92 7.08 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.783 0.325 . . . . 0.0 110.971 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.1 p -83.78 129.1 34.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.106 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.42 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.7 ttp180 -79.72 -54.47 5.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.813 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 17.3 m -127.9 163.01 25.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 62.45 46.72 5.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.778 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.987 -179.989 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.846 0.355 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -65.45 -47.83 74.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.983 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.11 -21.95 48.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.335 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.56 -22.06 63.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.293 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.42 ' CB ' ' HA ' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -103.56 25.71 9.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.778 0.323 . . . . 0.0 111.312 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.423 ' SG ' ' HA ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -69.76 142.46 91.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.341 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.423 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 86.3 Cg_endo -97.53 22.11 25.58 Favored 'Cis proline' 0 N--CA 1.457 -0.623 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.066 0.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 65.28 69.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 0.0 111.405 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.42 ' HA ' ' CB ' ' A' ' 6' ' ' ARG . 95.5 Cg_endo -80.24 -26.8 3.97 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.599 2.199 . . . . 0.0 112.435 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 m -137.01 -179.82 5.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.0 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.85 -171.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.979 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.01 135.36 36.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.014 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.03 -27.31 17.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.62 122.18 46.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.859 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.2 m -97.82 159.56 14.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.901 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 48.8 t -94.7 118.45 31.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.7 t -80.04 139.6 36.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.045 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -45.6 -32.04 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.651 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -22.37 34.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.71 37.21 3.05 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.22 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -156.08 144.4 19.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 68.2 m -74.58 175.07 8.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.898 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 166.36 -148.51 13.64 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.474 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 78.8 p -150.57 -170.52 3.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.75 -164.09 17.64 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.53 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.87 -29.19 32.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.796 0.332 . . . . 0.0 111.173 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.6 72.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.18 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.419 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.9 m-85 -109.82 -28.53 8.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 t -127.7 50.44 2.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.884 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -125.53 170.47 17.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.531 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.15 124.87 21.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 111.092 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.66 2.49 85.5 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -137.68 37.41 2.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.2 p -143.66 110.89 5.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -80.22 -62.93 1.53 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 80.0 m -118.95 157.58 27.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.9 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 62.24 46.42 6.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.794 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.5 t . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.964 179.951 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.878 0.37 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.423 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 6.4 p -62.23 -26.11 68.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.254 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.58 -31.11 66.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.0 p -70.67 -12.66 61.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.704 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.414 ' HB3' ' HA ' ' A' ' 10' ' ' PRO . 1.5 mtt85 -110.04 25.12 12.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.683 0.278 . . . . 0.0 111.425 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.461 ' SG ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -64.11 148.52 95.34 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.323 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 71.2 Cg_endo -98.31 20.35 26.1 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.432 -1.07 . . . . 0.0 113.081 0.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -137.06 67.33 55.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.749 0.309 . . . . 0.0 111.033 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.423 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 85.6 Cg_endo -83.59 -44.48 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.596 2.197 . . . . 0.0 112.695 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 m -109.04 166.46 10.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -67.83 -171.22 0.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.796 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 128.64 33.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.095 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 113.49 -22.52 15.05 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.611 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -109.7 169.18 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.84 0.352 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.2 m -140.24 178.0 7.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.931 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 39.7 t -112.9 118.45 34.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.813 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.6 p -87.63 137.5 32.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.113 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.441 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.9 pp -46.88 -32.15 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.69 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -56.73 -21.57 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.967 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.17 42.44 2.23 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.162 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -149.09 175.6 11.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.166 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.2 t -116.84 157.17 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.432 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 173.91 -149.13 10.58 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.485 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.8 m -147.04 -170.02 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.897 0.38 . . . . 0.0 111.0 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.08 -160.04 22.26 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.95 -24.34 38.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.76 0.314 . . . . 0.0 111.237 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.69 -37.14 75.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.159 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.432 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 83.7 m-85 -114.98 -34.34 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.022 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.66 42.96 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.924 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -113.97 -167.0 16.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.509 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.61 107.48 19.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.844 0.354 . . . . 0.0 111.063 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.06 -17.06 24.9 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.736 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -130.09 42.61 3.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.896 0.379 . . . . 0.0 110.904 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 t -146.54 107.72 4.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.441 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.5 OUTLIER -87.55 -50.68 6.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.051 179.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.9 m -123.42 157.24 33.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 62.51 46.82 5.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.909 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 34.1 m . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.912 179.966 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.7 p . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.895 0.379 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.62 -55.27 28.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.075 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.52 -36.09 63.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.325 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -68.86 -25.5 64.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.05 28.47 8.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.146 -179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 m -90.09 161.78 36.97 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.756 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -89.72 22.79 25.96 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.871 0.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.1 60.29 50.21 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.969 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -85.82 -46.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.762 2.308 . . . . 0.0 112.626 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.9 m -83.38 175.11 10.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.959 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -79.21 -175.68 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.89 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 131.78 35.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.082 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.35 -24.87 29.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.486 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -107.13 164.58 12.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -123.4 -170.44 2.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 37.8 t -123.77 131.0 53.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.034 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.96 143.12 26.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.918 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.406 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.5 pt -47.53 -28.53 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.816 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.19 -20.62 42.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.917 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 41.23 2.53 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.222 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -151.72 -175.92 5.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 47.8 m -122.48 164.18 18.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.744 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.428 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 176.14 -145.41 7.54 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.564 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.12 -170.42 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.868 0.366 . . . . 0.0 110.958 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.81 -173.9 25.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.511 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.43 -15.31 61.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.661 0.267 . . . . 0.0 111.45 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.4 -35.29 63.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.79 0.329 . . . . 0.0 111.393 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.428 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 85.5 m-85 -107.41 -31.29 8.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.171 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.4 m -108.67 26.45 10.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.044 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -64.13 -149.18 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.359 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.83 -36.34 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.372 . . . . 0.0 111.201 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.3 -20.61 5.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.744 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -79.88 -30.52 40.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.784 0.326 . . . . 0.0 111.017 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 27.6 p -82.93 127.93 33.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 22.0 ttp180 -92.3 -37.38 12.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.044 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.49 153.18 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.893 0.377 . . . . 0.0 111.013 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 63.0 47.35 4.32 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.827 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.984 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.824 0.345 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.1 p -55.84 -25.57 42.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.288 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.85 -37.4 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.893 0.378 . . . . 0.0 111.131 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.93 -25.58 62.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.212 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -103.1 21.4 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.394 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.409 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.18 164.36 28.01 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.615 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 97.6 Cg_endo -85.23 25.87 11.7 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 123.745 -1.356 . . . . 0.0 113.278 0.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.03 60.49 45.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.523 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 88.8 Cg_endo -85.69 -45.07 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.828 2.352 . . . . 0.0 112.821 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.9 m -119.56 176.58 5.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.011 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -169.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.756 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.91 128.4 33.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.061 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -23.26 11.54 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.399 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -110.78 138.95 46.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.826 0.346 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.5 m -118.21 169.09 9.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.893 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 49.0 t -97.01 117.06 30.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.954 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 p -76.9 139.31 40.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.055 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.3 pp -46.25 -39.11 3.49 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.088 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.838 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -57.82 -21.13 40.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.977 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.62 46.12 1.56 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.166 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -153.52 137.5 16.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 111.181 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -77.03 158.56 30.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.778 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 172.78 -165.76 38.23 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.569 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.4 m -129.32 -170.25 2.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.83 -174.1 4.44 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.98 -24.8 58.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.79 0.329 . . . . 0.0 111.218 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.6 77.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.231 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -119.55 0.37 11.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.53 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.7 t -152.65 35.89 0.5 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.814 0.34 . . . . 0.0 110.842 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.71 171.68 16.19 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.7 116.38 4.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.792 0.329 . . . . 0.0 111.14 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.03 -24.42 18.86 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.614 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -131.01 42.96 3.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.854 0.359 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 53.6 t -128.12 106.81 9.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.096 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -79.92 -58.9 2.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.6 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.37 170.07 17.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.609 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.74 45.33 7.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.74 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.091 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.88 0.371 . . . . 0.0 110.808 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.7 t -73.14 -56.86 4.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.079 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.81 -35.91 64.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.287 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.93 -26.61 64.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mtm-85 -107.94 23.94 13.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.282 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -90.18 160.39 40.18 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.8 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -87.69 28.71 11.3 Favored 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 123.631 -1.404 . . . . 0.0 112.925 0.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.59 57.3 27.64 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 0.0 110.823 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -82.22 -31.52 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.638 2.225 . . . . 0.0 112.464 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.13 175.83 5.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.125 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -96.87 -170.91 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.81 123.18 27.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.919 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.07 -20.08 24.31 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.359 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -114.41 179.61 3.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.82 0.343 . . . . 0.0 110.783 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 76.4 m -150.85 147.84 27.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.002 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.07 126.05 34.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.1 t -86.97 141.34 28.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.036 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.403 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.3 pt -47.23 -28.47 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.11 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -65.11 -14.28 60.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.2 40.24 4.31 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.998 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -152.48 139.91 19.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.167 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.4 m -75.06 172.94 11.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.28 -147.08 12.17 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.469 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 t -156.71 -170.85 3.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.909 0.385 . . . . 0.0 110.941 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.27 -160.38 46.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.5 -28.19 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 111.201 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.49 -35.26 79.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.234 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.419 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 89.8 m-85 -109.9 -29.95 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.8 t -124.06 53.24 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -90.78 -120.98 2.35 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.456 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.64 -43.67 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.923 0.392 . . . . 0.0 111.144 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.07 -12.05 18.95 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.718 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -103.81 27.07 7.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.711 0.291 . . . . 0.0 111.035 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 10.7 p -122.95 124.26 42.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.995 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -80.57 -56.46 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.867 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -136.8 162.42 33.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.931 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.22 46.19 6.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.614 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.5 t . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.857 179.906 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.8 p . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.885 0.374 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.1 t -60.46 -31.63 70.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.936 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.21 -32.39 72.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.055 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 t -69.94 -22.3 63.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.167 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 75.6 mtm-85 -101.53 25.68 8.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -83.31 159.72 61.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.798 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -87.43 12.1 54.39 Favored 'Cis proline' 0 C--N 1.346 0.437 0 C-N-CA 123.472 -1.47 . . . . 0.0 112.802 0.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -126.45 65.61 59.97 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.751 0.31 . . . . 0.0 111.005 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -82.3 -43.0 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.685 2.256 . . . . 0.0 112.425 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.5 m -93.66 162.67 13.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.047 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.74 -169.84 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.762 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.89 128.92 34.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.036 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.97 -23.14 28.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.477 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 mp -117.36 146.37 43.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.79 0.329 . . . . 0.0 110.902 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 m -111.88 171.84 7.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.34 124.07 40.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.42 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . 22.1 p -87.75 138.62 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.947 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.407 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.6 pt -46.99 -29.88 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.077 -179.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.53 -14.11 60.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.214 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.9 41.07 3.91 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.101 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -155.97 146.24 21.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.839 0.352 . . . . 0.0 111.153 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.1 m -82.56 167.11 18.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.909 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.426 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 173.36 -152.37 15.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.577 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.8 p -149.21 -169.33 3.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.924 0.393 . . . . 0.0 111.045 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.66 -166.68 51.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.521 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.77 57.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.656 0.265 . . . . 0.0 111.455 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.16 -33.3 44.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.289 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.426 ' CD2' ' HA3' ' A' ' 24' ' ' GLY . 48.1 m-85 -110.7 -30.51 7.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.1 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 67.0 m -118.86 37.67 4.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.821 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -88.65 -142.43 8.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.06 37.95 4.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 0.0 111.075 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -170.97 -41.21 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.419 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -80.28 -23.59 40.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.737 0.303 . . . . 0.0 111.08 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 22.6 p -79.98 106.25 11.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.032 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.407 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 27.5 ttp180 -80.25 -44.9 18.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.107 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.56 154.96 41.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.94 0.4 . . . . 0.0 111.293 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 63.72 46.92 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.112 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.906 0.384 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -95.54 -34.51 12.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.925 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.86 -40.25 96.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -26.34 66.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.474 ' HB3' ' HA ' ' A' ' 10' ' ' PRO . 2.7 mtt180 -79.87 -23.49 41.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.161 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -44.75 139.21 3.77 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -97.12 44.21 2.91 Favored 'Cis proline' 0 C--N 1.348 0.547 0 C-N-CA 124.388 -1.088 . . . . 0.0 113.21 0.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.438 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 2.3 mmt180 -143.42 51.99 1.89 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.638 0.256 . . . . 0.0 111.423 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.474 ' HA ' ' HB3' ' A' ' 6' ' ' ARG . 88.0 Cg_endo -82.78 -32.7 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.536 2.157 . . . . 0.0 112.565 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -141.36 171.09 14.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.63 -171.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.889 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.17 138.86 32.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.18 -28.22 12.43 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.471 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.98 161.71 13.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.807 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.4 m -133.13 163.69 28.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.0 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -100.96 128.51 46.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.711 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.5 p -90.05 143.08 27.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.227 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.436 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.4 pp -45.87 -37.5 2.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.101 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.875 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -56.42 -21.95 28.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.91 44.25 1.95 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.176 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -154.39 141.94 19.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.834 0.349 . . . . 0.0 111.191 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.81 168.94 18.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.818 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.466 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 170.51 -147.3 10.48 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.529 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -159.96 -176.65 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.4 -157.91 23.46 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.46 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -86.6 8.24 23.04 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.401 ' HB1' ' CD1' ' A' ' 29' ' ' TYR . . . -89.77 -36.41 15.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.806 0.336 . . . . 0.0 111.238 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.466 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 30.1 m-85 -127.87 1.14 6.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.673 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 t -125.33 -29.0 3.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.659 0.266 . . . . 0.0 111.296 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -56.3 176.75 0.87 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.773 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.16 154.06 42.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.341 . . . . 0.0 111.114 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 58.12 22.08 48.33 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.39 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -160.1 32.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.786 0.327 . . . . 0.0 110.709 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 44.5 t -141.26 118.21 11.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.098 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.436 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -87.56 -37.7 16.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.771 179.759 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.9 t -150.3 157.63 43.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.712 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 67.54 46.68 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.615 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.813 -179.974 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.1 p . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.888 0.375 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.4 p -85.28 -31.78 22.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.65 -50.87 70.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -179.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.36 -23.69 63.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.296 -179.773 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 25.95 9.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.267 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.425 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.16 164.71 26.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.711 179.916 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.425 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 90.5 Cg_endo -86.19 21.86 21.42 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.693 -1.378 . . . . 0.0 113.087 0.43 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.32 61.75 59.2 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.349 . . . . 0.0 110.829 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -86.32 -47.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.752 2.301 . . . . 0.0 112.813 -179.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.8 m -110.45 -178.59 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.889 0.376 . . . . 0.0 111.029 -179.734 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -63.9 -177.31 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.866 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 134.37 36.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.105 -179.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.83 -26.02 17.12 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -101.12 136.78 40.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.839 0.352 . . . . 0.0 110.956 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 30.3 m -104.57 161.81 13.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.851 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.9 t -97.79 106.34 18.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 p -67.1 139.9 57.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.83 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.4 pt -47.16 -33.77 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.797 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.84 -17.87 57.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.075 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.1 42.7 2.55 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.09 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -138.34 176.3 8.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 111.152 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -122.08 137.42 54.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.43 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -168.44 -158.87 12.97 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.548 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.6 p -142.31 -168.02 2.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.036 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.78 -169.88 19.76 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.511 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.2 -4.86 44.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.561 0.219 . . . . 0.0 111.582 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.93 -37.8 38.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.774 0.321 . . . . 0.0 111.24 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.43 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 66.7 m-85 -112.91 -28.06 7.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.385 -179.783 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.0 m -104.41 -23.1 13.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -57.51 155.33 19.04 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.617 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.56 145.86 37.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.804 0.335 . . . . 0.0 111.137 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.41 26.75 69.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.504 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -159.91 30.58 0.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.755 0.312 . . . . 0.0 110.921 -179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.26 125.71 11.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.991 -179.864 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.98 -58.42 3.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.854 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.411 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -131.67 168.45 17.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.877 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 62.94 46.81 4.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.808 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.981 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.873 0 N-CA-C 112.281 0.475 . . . . 2.21 112.281 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.4 p -148.51 40.21 0.92 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 2.21 110.866 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -67.99 -50.75 53.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.76 110.973 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -29.84 59.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 1.5 111.227 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -26.61 64.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 1.74 111.034 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -102.79 26.67 7.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 4.0199999999999996 111.079 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -83.92 162.17 53.18 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.417 . . . . 1.1899999999999999 110.794 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -81.79 0.87 48.11 Favored 'Cis proline' 0 C--N 1.346 0.413 0 C-N-CA 123.383 -1.507 . . . . 0.94999999999999996 112.857 0.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.99 70.0 3.71 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 120.773 0.32 . . . . 4.0800000000000001 111.009 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.79 -44.23 0.38 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.616 2.211 . . . . 0.81999999999999995 112.407 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 97.0 m -113.1 -178.25 3.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 1.3200000000000001 110.973 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.9 -172.81 2.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 2.0899999999999999 110.86 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.87 140.22 36.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 1.3799999999999999 111.06 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.85 -28.18 12.88 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.792 -0.718 . . . . 0.56999999999999995 112.448 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -106.48 158.59 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.825 0.345 . . . . 1.4299999999999999 110.82 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.3 m -128.03 150.6 49.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.56999999999999995 110.929 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -87.38 126.39 34.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 1.03 110.862 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.3 t -92.46 137.32 32.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 1.72 110.865 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.4 pt -47.42 -31.34 2.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 1.4199999999999999 111.568 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -58.13 -21.85 48.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 3.0 110.978 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 22' ' ' TYR . . . 104.92 39.18 2.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.722 -0.751 . . . . 0.58999999999999997 112.369 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 21' ' ' GLY . 74.8 m-85 -159.41 143.33 14.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.872 0.368 . . . . 2.4100000000000001 111.05 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.9 m -78.11 179.84 6.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 1.0700000000000001 110.814 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.425 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 160.57 -145.6 11.33 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.676 -0.773 . . . . 0.48999999999999999 112.57 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.91 -170.5 3.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.841 0.353 . . . . 1.9199999999999999 110.958 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.61 -160.52 28.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.58999999999999997 112.554 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.63 -28.76 28.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 1.24 111.202 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.23 -35.04 72.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 1.1699999999999999 111.167 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.425 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 97.7 m-85 -112.77 -33.15 6.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.228 -0.442 . . . . 2.23 111.066 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -115.21 44.47 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 1.24 110.909 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -103.34 162.48 15.9 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.713 -0.755 . . . . 1.0800000000000001 112.526 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.5 103.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.81 0.338 . . . . 1.8400000000000001 111.122 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.59 -23.19 32.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.694 -0.765 . . . . 1.3500000000000001 112.619 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -103.58 27.15 7.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.731 0.301 . . . . 1.48 110.968 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.6 p -137.41 124.27 21.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.357 -0.383 . . . . 1.3500000000000001 110.962 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -79.87 -37.84 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 2.6800000000000002 110.872 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 m -146.52 167.69 23.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 1.05 110.942 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 61.84 46.11 7.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.8700000000000001 110.738 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.5 m -100.33 -31.65 11.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.991 -0.549 . . . . 1.29 110.882 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -82.49 -32.62 28.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.132 -0.486 . . . . 6.1399999999999997 110.905 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.376 -1.236 . . . . 3.0600000000000001 112.502 179.987 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 p -148.44 46.07 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.9 p -69.88 -21.53 63.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.2 -31.67 65.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.839 0.352 . . . . 0.0 111.305 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.4 t -67.69 -19.4 65.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.455 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -112.34 31.57 6.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 111.283 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 m -69.01 162.22 66.72 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -91.63 8.77 62.54 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.845 -1.314 . . . . 0.0 112.909 0.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 -135.01 66.91 69.23 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.0 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -83.36 -42.87 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.733 2.289 . . . . 0.0 112.483 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.75 179.22 7.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.952 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.33 -171.6 3.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.801 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.11 134.04 35.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.047 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.68 -26.07 23.67 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.474 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -112.14 140.08 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.83 0.348 . . . . 0.0 110.892 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.0 m -108.85 166.82 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.768 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 3.8 m -102.55 124.45 48.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.985 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.1 t -83.97 143.49 29.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.455 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.3 pp -47.8 -27.67 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.061 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -71.79 -5.91 37.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.541 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.86 6.35 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -133.73 179.37 6.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.855 0.36 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.71 148.83 51.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.792 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.87 -137.06 2.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.616 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.9 t -155.34 -169.0 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.984 0.421 . . . . 0.0 110.975 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.83 -171.97 25.47 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.509 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.62 -9.88 59.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.559 0.219 . . . . 0.0 111.523 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.95 -37.0 56.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.8 0.333 . . . . 0.0 111.207 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -110.39 -27.4 9.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.112 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.3 m -111.37 29.92 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.989 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -108.01 159.27 14.46 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.517 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.15 119.98 16.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.123 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.2 -28.19 11.44 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -107.5 -27.91 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.787 0.327 . . . . 0.0 110.973 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 45.5 t -85.58 105.9 16.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.455 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 7.6 ttp180 -79.99 -47.8 14.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.264 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.23 160.95 33.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 111.268 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? 62.31 46.17 6.18 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.821 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 m -103.03 -31.69 10.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.855 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -98.41 -32.06 11.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.978 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.413 -1.215 . . . . 0.0 112.544 -179.982 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.918 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.77 53.47 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.806 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.8 p -84.13 2.68 38.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.505 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.24 -30.35 68.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.786 0.327 . . . . 0.0 111.145 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 p -68.61 -22.05 64.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.317 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.15 29.93 6.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.798 0.332 . . . . 0.0 110.995 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.416 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.24 164.27 53.1 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.823 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 6.5 Cg_endo -87.52 4.06 69.21 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 124.064 -1.223 . . . . 0.0 112.859 0.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -127.64 69.54 75.88 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 120.924 0.392 . . . . 0.0 110.907 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -81.03 -43.2 0.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.622 2.215 . . . . 0.0 112.396 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 51.5 m -85.74 162.14 18.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -63.93 -173.59 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.13 134.3 36.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.075 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 105.83 -26.17 21.81 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.498 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mp -105.17 169.32 8.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.33 . . . . 0.0 110.885 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 m -146.21 150.25 35.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -87.26 126.16 34.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.29 142.64 30.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.066 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.415 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.3 pt -47.17 -32.01 2.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.828 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -61.75 -18.41 59.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.083 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.81 40.21 2.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.064 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -139.38 -176.58 4.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 110.94 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.4 t -132.5 155.59 48.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.406 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 173.91 -132.28 2.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.547 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.07 -172.01 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.857 0.36 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.41 -160.21 46.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.46 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.91 -29.55 29.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.784 0.326 . . . . 0.0 111.099 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.05 79.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.227 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.406 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 70.9 m-85 -108.18 -29.73 8.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.007 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 2.0 t -120.38 39.53 3.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.098 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.62 171.79 53.01 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.352 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.46 65.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.897 0.38 . . . . 0.0 111.038 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.14 28.54 7.21 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.345 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -148.78 28.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.789 0.328 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.1 p -124.6 123.14 39.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.2 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.415 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.5 tpp180 -79.93 -41.8 25.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.48 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 m -151.61 161.23 43.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.45 46.43 5.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.021 0.439 . . . . 0.0 110.617 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 59.9 m -79.33 -30.74 42.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.913 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.64 -31.32 52.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.875 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.516 -179.963 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.9 t -151.58 43.57 0.75 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.92 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.1 p -65.54 -25.45 67.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.038 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.72 -35.32 74.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.5 m -64.59 -15.9 61.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.734 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -123.34 37.94 4.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.669 0.271 . . . . 0.0 111.374 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.9 m -74.17 160.05 82.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.767 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -89.65 6.83 68.34 Favored 'Cis proline' 0 N--CA 1.46 -0.482 0 C-N-CA 123.576 -1.426 . . . . 0.0 112.753 0.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 77.52 62.24 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.51 -30.29 2.55 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.603 2.202 . . . . 0.0 112.616 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.1 m -115.08 175.28 5.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.053 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -63.45 -170.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.923 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 133.6 36.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.76 -26.35 18.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.44 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.93 165.11 14.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.801 0.334 . . . . 0.0 110.835 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.6 m -143.07 149.66 38.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.11 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.1 t -90.37 109.04 20.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.527 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.4 p -74.44 140.03 44.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.108 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.485 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.0 pp -46.98 -34.36 2.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.87 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -59.64 -19.4 48.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.067 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.21 41.02 2.68 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.044 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -137.27 173.98 11.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.9 0.381 . . . . 0.0 111.02 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.25 129.03 49.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.841 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.427 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -162.62 -145.17 4.25 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.483 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -142.79 -172.98 3.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.81 -162.43 11.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.464 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.73 -26.2 54.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.77 0.319 . . . . 0.0 111.26 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.53 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.342 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.427 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.0 m-85 -127.43 5.57 6.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -150.65 30.52 0.66 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.878 0.37 . . . . 0.0 110.924 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.07 -171.6 47.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.544 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -76.83 -32.23 57.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.67 16.63 12.39 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.667 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -141.73 33.83 1.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.786 0.327 . . . . 0.0 110.75 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.9 t -136.22 104.33 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.198 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.485 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.5 OUTLIER -79.92 -52.58 7.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.719 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.48 164.2 21.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 61.37 45.86 8.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.3 m -106.63 -30.36 9.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.925 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -109.88 29.58 7.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.902 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.386 -1.23 . . . . 0.0 112.498 179.965 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.885 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.0 p -112.15 32.26 5.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.882 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.56 -48.52 74.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.11 -37.6 85.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.125 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 m -68.78 -28.73 67.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.063 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.61 28.06 7.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.018 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.402 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 3.4 m -90.0 162.63 34.8 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.851 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 80.6 Cg_endo -89.21 17.31 41.46 Favored 'Cis proline' 0 C--N 1.347 0.466 0 C-N-CA 123.66 -1.392 . . . . 0.0 112.893 0.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -129.32 63.4 67.39 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.922 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -82.84 -43.01 0.09 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.693 2.262 . . . . 0.0 112.357 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.2 m -94.62 163.68 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -74.05 -173.33 1.58 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.08 133.37 36.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.08 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 -25.68 25.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.54 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -109.49 137.46 47.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.355 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 74.6 m -107.73 151.09 26.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.1 119.6 33.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.046 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.419 ' HB2' ' CD2' ' A' ' 29' ' ' TYR . 0.4 OUTLIER -77.98 146.18 35.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.702 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.435 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.9 pt -44.58 -30.18 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.033 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.401 ' N ' HG13 ' A' ' 19' ' ' ILE . 2.8 m-85 -59.91 -18.98 49.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.957 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.21 41.96 3.35 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.044 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -150.56 144.35 25.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.928 0.394 . . . . 0.0 111.404 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 m -79.67 158.2 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.917 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.425 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . -178.89 -139.36 3.53 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.563 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.01 -170.93 3.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 0.0 110.97 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.34 -166.71 10.85 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.542 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.18 -27.34 47.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.795 0.331 . . . . 0.0 111.184 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.14 73.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.128 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.425 ' CD2' ' HA3' ' A' ' 24' ' ' GLY . 10.8 m-85 -109.54 -27.4 9.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.004 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.4 t -122.18 48.29 1.76 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -122.54 159.22 17.19 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.498 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.15 116.48 3.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.791 0.329 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.19 -16.69 45.4 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.662 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 50.8 m-20 -132.11 44.12 2.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.881 0.372 . . . . 0.0 110.843 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.1 t -127.2 105.8 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.107 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.435 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -79.79 -57.53 3.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.792 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.5 m -143.88 169.5 17.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.876 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 61.86 46.16 7.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -24.6 34.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.993 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -30.79 64.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.968 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.373 -1.237 . . . . 0.0 112.484 179.954 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.899 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p -153.25 35.88 0.47 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.821 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.5 p -62.41 -30.91 71.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.04 -39.19 74.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.297 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 t -70.32 -21.04 62.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.215 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -97.24 23.07 7.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.148 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.5 m -70.52 161.09 78.92 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.832 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -84.71 1.37 62.02 Favored 'Cis proline' 0 C--N 1.347 0.469 0 C-N-CA 123.475 -1.469 . . . . 0.0 112.862 0.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -126.5 76.75 73.66 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.768 0.318 . . . . 0.0 110.967 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.98 -66.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.746 2.298 . . . . 0.0 112.337 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.1 m -95.95 179.77 4.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.039 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.39 -170.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.952 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.96 137.03 36.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.005 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.14 -28.23 12.46 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.446 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.04 169.81 9.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.8 0.333 . . . . 0.0 110.853 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 m -141.97 150.35 41.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 43.1 t -98.22 108.22 20.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.25 137.52 46.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.448 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.0 pt -46.11 -33.19 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.903 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.54 -20.31 45.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.019 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 101.18 41.91 2.5 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.142 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 6.5 m-85 -148.01 146.49 28.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 111.171 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -91.65 152.77 20.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.773 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.27 -144.62 5.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.577 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.0 t -157.45 -169.87 3.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.834 0.349 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.35 -167.56 18.17 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.511 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.62 -12.25 60.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.686 0.279 . . . . 0.0 111.525 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.75 -34.31 66.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.791 0.329 . . . . 0.0 111.194 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -116.74 -21.02 9.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.515 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 -12.16 14.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.669 -0.242 . . . . 0.0 111.477 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.7 162.85 44.57 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.497 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.58 149.86 49.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.834 0.349 . . . . 0.0 111.121 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.29 24.15 58.62 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.527 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -160.06 39.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.9 p -159.97 120.29 2.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.078 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.448 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 9.5 ttm180 -79.82 -56.92 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.3 m -123.85 165.81 16.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.42 46.97 4.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.862 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -131.2 -44.98 1.02 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.921 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.18 -29.58 19.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.911 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.415 -1.214 . . . . 0.0 112.456 179.969 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.889 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.3 p -138.97 40.88 2.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.911 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.2 t -74.66 -43.69 54.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.2 -40.32 97.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.131 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.1 m -70.16 -23.85 63.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.275 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -98.07 23.66 7.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.115 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 8' ' ' PRO . 23.3 m -78.89 161.52 68.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.636 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.431 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 71.0 Cg_endo -87.46 4.34 69.15 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.706 -1.372 . . . . 0.0 112.987 0.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.32 73.67 67.47 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 0.0 111.085 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.85 -42.97 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.565 2.177 . . . . 0.0 112.243 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.9 m -114.03 176.9 4.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.971 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.48 -174.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.969 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 146.76 31.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.93 -25.18 28.27 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.47 154.23 20.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.816 0.341 . . . . 0.0 110.905 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.9 m -120.03 150.56 40.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.963 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.4 t -84.56 113.7 21.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.998 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.44 137.64 37.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.759 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 29.5 pt -45.72 -37.0 2.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.824 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -56.54 -22.43 33.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.965 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 103.93 41.04 2.19 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.184 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.408 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 20.7 m-85 -153.67 143.03 21.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.817 0.342 . . . . 0.0 111.149 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.52 169.44 18.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.435 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 168.07 -150.42 16.4 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.417 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -152.44 -169.49 3.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.935 0.398 . . . . 0.0 111.004 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.19 -160.2 35.76 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.5 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.78 -30.6 26.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.859 0.361 . . . . 0.0 111.16 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -35.62 72.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.435 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 53.2 m-85 -110.63 -28.5 8.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.042 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 47.55 2.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 110.952 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -104.02 165.27 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.436 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.28 92.59 1.04 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 111.102 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.0 16.03 14.76 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.651 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -137.05 12.8 3.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.607 0.241 . . . . 0.0 111.232 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.3 p -127.43 137.98 52.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 110.864 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.97 -53.52 6.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.945 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 p -149.55 169.03 21.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.52 47.73 2.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.792 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.6 m -102.46 26.34 7.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.953 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -82.67 -33.01 27.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.869 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 CA-C-O 118.397 -1.224 . . . . 0.0 112.477 179.997 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.887 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t -148.79 34.31 0.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.854 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 t -64.88 -47.64 77.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.974 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.41 86.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.128 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -22.75 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.093 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 28.32 7.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.806 0.336 . . . . 0.0 111.059 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.406 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.77 162.88 58.6 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.778 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 81.2 Cg_endo -89.62 14.12 51.11 Favored 'Cis proline' 0 C--N 1.347 0.497 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.819 0.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.28 63.42 67.39 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.808 0.337 . . . . 0.0 110.972 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -84.12 -44.06 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.726 2.284 . . . . 0.0 112.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.3 m -82.08 154.6 25.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.898 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.4 -170.85 0.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.832 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.84 120.29 24.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.99 -12.27 17.39 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.765 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -134.35 139.57 45.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -92.94 -178.1 4.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.0 t -113.51 123.22 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.789 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.2 p -83.93 145.8 28.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.402 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.501 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.8 pt -46.66 -27.18 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.105 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.085 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -75.0 0.65 15.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.607 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.96 37.59 18.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.017 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -129.6 178.41 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 111.053 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.403 ' O ' ' CE1' ' A' ' 29' ' ' TYR . 71.1 m -126.79 157.86 38.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.85 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.417 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 169.84 -147.89 11.31 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.623 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.16 -168.01 2.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.967 0.413 . . . . 0.0 111.046 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.35 -165.79 26.82 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.521 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 -27.48 54.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.789 0.328 . . . . 0.0 111.112 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.51 75.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.417 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 88.0 m-85 -107.58 -30.19 8.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.109 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.4 m -115.09 38.92 3.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.987 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.49 -166.99 40.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.439 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.38 -35.7 14.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.893 0.378 . . . . 0.0 111.155 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.67 23.46 29.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.494 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -153.98 43.96 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 7.6 t -125.54 102.79 7.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.041 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.501 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 2.9 tpt180 -79.84 -46.25 17.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.825 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.3 m -150.1 168.38 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 62.48 46.15 5.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.813 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.7 m -97.57 -30.8 12.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.927 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.86 -31.09 28.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.893 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.381 -1.233 . . . . 0.0 112.453 -179.967 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.887 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.8 p -131.03 43.11 3.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.807 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 t -86.35 -49.07 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.968 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.91 71.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.191 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.6 -27.43 66.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.065 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.95 28.99 7.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.972 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -89.97 163.03 33.71 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.741 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -87.81 4.84 69.33 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.655 -1.394 . . . . 0.0 112.907 0.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -120.84 66.9 14.28 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.362 . . . . 0.0 111.113 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -77.58 -43.33 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.58 2.187 . . . . 0.0 112.481 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.0 m -105.87 171.7 7.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.06 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.9 -170.02 2.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.935 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.92 134.04 36.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.011 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.07 -26.79 9.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.367 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -114.63 147.38 39.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.869 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -119.95 146.35 45.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.858 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.5 t -85.13 119.18 25.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.744 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.8 t -77.76 145.27 36.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.4 pt -46.79 -26.01 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.104 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.45 9.74 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.532 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.8 44.76 37.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.621 -0.8 . . . . 0.0 112.278 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -145.52 122.17 11.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.809 0.338 . . . . 0.0 111.205 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -73.3 170.04 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.775 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 158.66 -152.7 23.83 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.596 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.5 p -145.11 -168.21 2.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.391 . . . . 0.0 111.06 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.33 -169.94 42.87 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.39 -16.35 58.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.682 0.277 . . . . 0.0 111.435 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.03 -34.02 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.759 0.314 . . . . 0.0 111.309 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CD2' ' HA3' ' A' ' 24' ' ' GLY . 74.1 m-85 -107.96 -33.66 7.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.204 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.7 m -108.71 28.2 8.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.044 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -79.73 -174.84 47.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.557 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.35 -33.01 16.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.35 . . . . 0.0 111.066 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.55 19.66 44.34 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.602 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -152.79 48.45 0.73 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.362 . . . . 0.0 110.726 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.3 t -126.35 103.32 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -79.89 -54.79 5.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.7 m -138.56 170.31 16.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.943 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.39 47.37 3.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.72 25.35 7.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.0 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -147.71 30.7 0.89 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.847 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.399 -1.223 . . . . 0.0 112.524 -179.993 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.863 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p -141.39 45.28 1.74 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.804 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.449 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 19.4 p -79.67 -21.03 45.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.186 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.87 -26.38 24.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.728 0.299 . . . . 0.0 111.389 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.6 p -74.24 -14.48 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.523 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -96.02 9.62 40.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.573 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.27 144.16 83.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.428 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -95.78 26.85 19.38 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.315 -1.119 . . . . 0.0 112.968 0.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.455 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 11.8 mtm-85 -130.82 53.4 11.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.662 0.268 . . . . 0.0 111.355 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.455 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 95.6 Cg_endo -84.9 -43.59 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.573 2.182 . . . . 0.0 112.714 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 t -100.0 170.75 8.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.107 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -81.8 -174.63 5.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.02 129.37 34.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.096 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.7 -22.41 37.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.616 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.6 166.52 11.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 110.981 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -132.98 155.04 49.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.765 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.63 103.69 16.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.844 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.49 140.56 56.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.001 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pp -45.87 -39.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.806 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -56.61 -22.41 33.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.988 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.89 45.93 1.44 Allowed Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.119 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -152.77 133.03 13.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.158 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.25 162.18 28.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.843 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 168.52 -159.44 32.6 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.53 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -144.81 -177.37 5.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.796 0.332 . . . . 0.0 110.846 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.62 -169.87 8.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.3 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.51 -15.88 61.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.61 0.243 . . . . 0.0 111.371 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.57 78.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.717 0.294 . . . . 0.0 111.414 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -133.37 17.0 4.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.4 t -160.08 30.2 0.17 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.05 176.93 32.26 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.502 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.12 109.28 2.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.823 0.344 . . . . 0.0 111.075 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.23 -23.06 37.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.617 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -107.94 29.93 6.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.813 0.34 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.7 t -129.04 118.22 22.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.02 -64.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.966 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 80.6 m -127.4 163.84 23.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.872 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.4 46.68 4.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.82 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 m -100.75 23.54 10.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.12 -33.46 7.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.878 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.509 -179.984 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.902 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.4 p -158.8 45.11 0.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.792 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -73.64 -40.89 63.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.33 -32.63 74.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.145 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 -26.44 65.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.037 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 mtp180 -106.22 28.98 7.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.958 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.427 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.3 m -85.03 164.7 40.53 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 79.0 Cg_endo -86.67 2.84 68.1 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.65 -1.396 . . . . 0.0 112.915 0.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -124.34 68.96 50.49 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.98 -27.28 2.55 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.617 2.211 . . . . 0.0 112.579 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -109.2 171.72 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.072 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -71.58 -174.22 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 133.46 36.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.97 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.82 -26.82 11.08 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.336 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.8 170.29 7.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.749 0.309 . . . . 0.0 110.803 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.2 m -141.62 161.33 38.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.933 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.7 t -93.72 132.74 37.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.088 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -93.68 138.4 31.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.891 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.2 pp -45.69 -38.12 2.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.819 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -57.0 -22.16 36.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.074 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.05 41.41 2.11 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.072 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -154.27 141.01 19.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.854 0.359 . . . . 0.0 111.034 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -74.18 175.57 7.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.899 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.2 -146.65 11.68 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.427 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 m -155.49 -170.89 3.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.886 0.374 . . . . 0.0 110.967 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.16 -160.91 42.16 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.441 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.58 -29.93 25.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.737 0.303 . . . . 0.0 111.087 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.15 -36.31 79.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.208 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.419 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 79.2 m-85 -108.12 -29.77 8.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.008 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 5.0 t -126.33 48.83 2.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.96 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.64 -146.34 19.69 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.411 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -119.98 76.16 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 111.038 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.05 -27.94 3.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.401 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -98.08 21.74 10.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.675 0.274 . . . . 0.0 111.042 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 19.6 p -120.22 135.31 55.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.35 . . . . 0.0 110.913 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.97 -39.94 29.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.866 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.8 m -148.75 166.12 29.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.28 46.75 2.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.8 m -102.74 -28.41 12.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.963 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.52 24.73 7.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.922 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.403 -1.22 . . . . 0.0 112.489 180.0 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.916 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.9 p -148.63 44.11 1.01 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.783 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.7 t -78.51 -32.73 48.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.903 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.21 86.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.058 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -70.26 -22.71 62.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.02 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.1 mtp180 -79.92 -21.47 43.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.134 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.415 ' HB3' ' HA ' ' A' ' 8' ' ' PRO . 51.2 m -52.68 160.24 1.47 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.951 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.415 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 63.1 Cg_endo -90.35 18.75 38.3 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.897 0.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.18 66.32 45.28 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.748 0.309 . . . . 0.0 111.231 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -71.85 -42.73 1.51 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.771 2.314 . . . . 0.0 112.261 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.8 m -122.15 172.17 8.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.103 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 140.03 36.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.045 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.28 -27.95 14.17 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.432 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.78 171.77 8.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.813 0.34 . . . . 0.0 110.916 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.6 m -146.89 159.37 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.836 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.2 t -98.33 127.28 44.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 t -88.91 139.34 30.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 21.1 pt -46.01 -36.72 2.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.823 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -19.66 29.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.083 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.77 46.53 1.92 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.112 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -154.13 142.99 21.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.915 0.388 . . . . 0.0 111.283 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.4 ' O ' ' CD2' ' A' ' 29' ' ' TYR . 0.5 OUTLIER -81.59 170.66 15.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.797 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.438 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 159.81 -150.27 20.45 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.578 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.1 t -148.42 -170.06 3.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.912 0.386 . . . . 0.0 110.994 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.39 -157.14 37.42 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.516 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.48 -26.76 29.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 0.0 111.194 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.26 75.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.17 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.438 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 34.2 m-85 -116.56 -17.96 10.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.447 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -129.81 32.25 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.761 0.315 . . . . 0.0 110.958 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.15 177.52 39.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.506 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.67 132.12 42.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.86 0.362 . . . . 0.0 111.14 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.19 24.56 58.88 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.468 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -143.28 23.48 1.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 111.134 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.2 p -131.36 125.73 33.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.015 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -43.95 21.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.974 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -136.34 167.66 20.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.961 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 61.64 45.82 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.793 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.1 m -104.2 -31.87 9.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.875 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -143.69 30.93 1.32 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.902 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.385 -1.231 . . . . 0.0 112.5 179.966 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.912 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.2 p 63.14 49.92 3.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.618 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.8 m -49.38 -54.73 15.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.231 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -52.8 -41.71 64.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.241 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.8 t -67.26 -27.39 67.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.032 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.3 mtm105 -118.41 30.07 7.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.04 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.422 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.6 m -84.98 164.2 42.75 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.726 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 72.6 Cg_endo -89.83 19.98 33.94 Favored 'Cis proline' 0 C--N 1.347 0.495 0 C-N-CA 123.791 -1.337 . . . . 0.0 112.936 0.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.413 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 31.8 mtp180 -137.59 64.82 45.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.701 0.286 . . . . 0.0 111.199 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.413 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 17.3 Cg_exo -67.1 -51.66 0.75 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.585 2.19 . . . . 0.0 112.104 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.03 -177.06 4.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -72.43 -174.99 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 139.96 35.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.113 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.72 -25.25 28.14 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.448 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -108.36 144.06 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.831 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.3 m -108.58 139.78 42.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.744 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.88 106.37 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.8 p -66.24 140.82 58.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.034 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.42 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.3 pp -48.12 -33.71 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.655 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -56.71 -22.87 38.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.032 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.27 41.44 1.78 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.38 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -158.81 134.51 8.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.838 0.351 . . . . 0.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.67 152.12 20.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 29' ' ' TYR . . . -174.43 -136.37 2.23 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.484 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -147.92 -169.9 3.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.915 0.388 . . . . 0.0 110.919 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 -161.38 45.59 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.499 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.25 -25.87 36.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.771 0.32 . . . . 0.0 111.219 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.31 80.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.239 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.436 ' CD2' ' N ' ' A' ' 24' ' ' GLY . 54.3 m-85 -108.91 -37.97 5.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.073 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 77.8 m -114.04 47.97 1.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.949 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.67 -155.75 30.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.478 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.7 115.32 29.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.856 0.36 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.06 10.7 86.03 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.764 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 39.7 m-20 -113.33 -29.92 7.08 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.783 0.325 . . . . 0.0 110.971 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.1 p -83.78 129.1 34.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.106 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.42 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.7 ttp180 -79.72 -54.47 5.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.813 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 17.3 m -127.9 163.01 25.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 62.45 46.72 5.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.778 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.7 m -92.79 -28.77 16.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.987 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.86 27.29 7.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.919 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.394 -1.225 . . . . 0.0 112.461 179.985 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.863 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.2 p -103.64 27.72 7.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -65.45 -47.83 74.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.983 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.11 -21.95 48.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.335 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.56 -22.06 63.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.293 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.42 ' CB ' ' HA ' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -103.56 25.71 9.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.778 0.323 . . . . 0.0 111.312 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.423 ' SG ' ' HA ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -69.76 142.46 91.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.341 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.423 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 86.3 Cg_endo -97.53 22.11 25.58 Favored 'Cis proline' 0 N--CA 1.457 -0.623 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.066 0.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 65.28 69.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 0.0 111.405 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.42 ' HA ' ' CB ' ' A' ' 6' ' ' ARG . 95.5 Cg_endo -80.24 -26.8 3.97 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.599 2.199 . . . . 0.0 112.435 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 m -137.01 -179.82 5.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.0 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.85 -171.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.979 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.01 135.36 36.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.014 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.03 -27.31 17.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.62 122.18 46.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.859 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.2 m -97.82 159.56 14.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.901 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 48.8 t -94.7 118.45 31.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.7 t -80.04 139.6 36.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.045 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -45.6 -32.04 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.651 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -22.37 34.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.71 37.21 3.05 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.22 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -156.08 144.4 19.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 68.2 m -74.58 175.07 8.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.898 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 166.36 -148.51 13.64 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.474 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 78.8 p -150.57 -170.52 3.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.75 -164.09 17.64 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.53 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.87 -29.19 32.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.796 0.332 . . . . 0.0 111.173 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.6 72.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.18 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.419 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.9 m-85 -109.82 -28.53 8.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 t -127.7 50.44 2.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.884 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -125.53 170.47 17.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.531 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.15 124.87 21.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 111.092 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.66 2.49 85.5 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -137.68 37.41 2.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.2 p -143.66 110.89 5.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -80.22 -62.93 1.53 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 80.0 m -118.95 157.58 27.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.9 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 62.24 46.42 6.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.794 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.5 t -114.6 -36.35 4.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.964 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.9 tpt85 -78.0 -32.43 51.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.935 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.365 -1.242 . . . . 0.0 112.477 179.993 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.91 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p 58.18 38.11 26.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.755 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.423 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 6.4 p -62.23 -26.11 68.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.254 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.58 -31.11 66.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.0 p -70.67 -12.66 61.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.704 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.414 ' HB3' ' HA ' ' A' ' 10' ' ' PRO . 1.5 mtt85 -110.04 25.12 12.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.683 0.278 . . . . 0.0 111.425 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.461 ' SG ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -64.11 148.52 95.34 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.323 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 71.2 Cg_endo -98.31 20.35 26.1 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.432 -1.07 . . . . 0.0 113.081 0.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -137.06 67.33 55.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.749 0.309 . . . . 0.0 111.033 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.423 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 85.6 Cg_endo -83.59 -44.48 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.596 2.197 . . . . 0.0 112.695 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 m -109.04 166.46 10.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -67.83 -171.22 0.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.796 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 128.64 33.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.095 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 113.49 -22.52 15.05 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.611 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -109.7 169.18 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.84 0.352 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.2 m -140.24 178.0 7.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.931 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 39.7 t -112.9 118.45 34.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.813 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.6 p -87.63 137.5 32.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.113 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.441 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.9 pp -46.88 -32.15 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.69 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -56.73 -21.57 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.967 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.17 42.44 2.23 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.162 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -149.09 175.6 11.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.166 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.2 t -116.84 157.17 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.432 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 173.91 -149.13 10.58 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.485 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.8 m -147.04 -170.02 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.897 0.38 . . . . 0.0 111.0 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.08 -160.04 22.26 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.95 -24.34 38.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.76 0.314 . . . . 0.0 111.237 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.69 -37.14 75.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.159 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.432 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 83.7 m-85 -114.98 -34.34 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.022 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.66 42.96 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.924 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -113.97 -167.0 16.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.509 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.61 107.48 19.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.844 0.354 . . . . 0.0 111.063 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.06 -17.06 24.9 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.736 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -130.09 42.61 3.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.896 0.379 . . . . 0.0 110.904 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 t -146.54 107.72 4.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.441 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.5 OUTLIER -87.55 -50.68 6.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.051 179.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.9 m -123.42 157.24 33.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 62.51 46.82 5.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.909 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 34.1 m -101.13 -31.57 10.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.912 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ptt-85 -79.2 -30.96 43.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.852 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.386 -1.23 . . . . 0.0 112.494 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.871 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.7 p -130.11 42.97 3.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.749 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.62 -55.27 28.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.075 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.52 -36.09 63.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.325 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -68.86 -25.5 64.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.05 28.47 8.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.146 -179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 m -90.09 161.78 36.97 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.756 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -89.72 22.79 25.96 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.871 0.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.1 60.29 50.21 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.969 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -85.82 -46.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.762 2.308 . . . . 0.0 112.626 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.9 m -83.38 175.11 10.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.959 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -79.21 -175.68 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.89 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 131.78 35.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.082 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.35 -24.87 29.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.486 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -107.13 164.58 12.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -123.4 -170.44 2.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 37.8 t -123.77 131.0 53.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.034 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.96 143.12 26.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.918 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.406 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.5 pt -47.53 -28.53 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.816 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.19 -20.62 42.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.917 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 41.23 2.53 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.222 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -151.72 -175.92 5.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 47.8 m -122.48 164.18 18.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.744 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.428 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 176.14 -145.41 7.54 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.564 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.12 -170.42 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.868 0.366 . . . . 0.0 110.958 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.81 -173.9 25.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.511 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.43 -15.31 61.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.661 0.267 . . . . 0.0 111.45 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.4 -35.29 63.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.79 0.329 . . . . 0.0 111.393 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.428 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 85.5 m-85 -107.41 -31.29 8.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.171 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.4 m -108.67 26.45 10.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.044 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -64.13 -149.18 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.359 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.83 -36.34 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.372 . . . . 0.0 111.201 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.3 -20.61 5.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.744 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -79.88 -30.52 40.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.784 0.326 . . . . 0.0 111.017 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 27.6 p -82.93 127.93 33.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 22.0 ttp180 -92.3 -37.38 12.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.044 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.49 153.18 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.893 0.377 . . . . 0.0 111.013 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 63.0 47.35 4.32 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.827 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.3 m -91.99 -35.22 14.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -91.1 -31.22 16.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.913 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.399 -1.223 . . . . 0.0 112.496 -179.987 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.916 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p 58.14 34.97 24.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.969 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.1 p -55.84 -25.57 42.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.288 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.85 -37.4 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.893 0.378 . . . . 0.0 111.131 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.93 -25.58 62.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.212 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -103.1 21.4 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.394 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.409 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.18 164.36 28.01 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.615 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 97.6 Cg_endo -85.23 25.87 11.7 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 123.745 -1.356 . . . . 0.0 113.278 0.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.03 60.49 45.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.523 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 88.8 Cg_endo -85.69 -45.07 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.828 2.352 . . . . 0.0 112.821 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.9 m -119.56 176.58 5.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.011 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -169.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.756 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.91 128.4 33.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.061 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -23.26 11.54 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.399 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -110.78 138.95 46.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.826 0.346 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.5 m -118.21 169.09 9.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.893 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 49.0 t -97.01 117.06 30.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.954 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 p -76.9 139.31 40.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.055 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.3 pp -46.25 -39.11 3.49 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.088 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.838 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -57.82 -21.13 40.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.977 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.62 46.12 1.56 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.166 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -153.52 137.5 16.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 111.181 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -77.03 158.56 30.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.778 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 172.78 -165.76 38.23 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.569 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.4 m -129.32 -170.25 2.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.83 -174.1 4.44 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.98 -24.8 58.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.79 0.329 . . . . 0.0 111.218 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.6 77.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.231 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -119.55 0.37 11.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.53 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.7 t -152.65 35.89 0.5 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.814 0.34 . . . . 0.0 110.842 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.71 171.68 16.19 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.7 116.38 4.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.792 0.329 . . . . 0.0 111.14 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.03 -24.42 18.86 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.614 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -131.01 42.96 3.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.854 0.359 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 53.6 t -128.12 106.81 9.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.096 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -79.92 -58.9 2.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.6 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.37 170.07 17.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.609 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.74 45.33 7.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.74 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -20.94 47.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.091 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -29.04 62.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.025 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.089 0 CA-C-O 118.365 -1.242 . . . . 0.0 112.421 -179.968 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.944 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 p -135.41 45.27 2.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.808 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.7 t -73.14 -56.86 4.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.079 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.81 -35.91 64.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.287 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.93 -26.61 64.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mtm-85 -107.94 23.94 13.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.282 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -90.18 160.39 40.18 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.8 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -87.69 28.71 11.3 Favored 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 123.631 -1.404 . . . . 0.0 112.925 0.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.59 57.3 27.64 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 0.0 110.823 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -82.22 -31.52 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.638 2.225 . . . . 0.0 112.464 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.13 175.83 5.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.125 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -96.87 -170.91 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.81 123.18 27.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.919 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.07 -20.08 24.31 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.359 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -114.41 179.61 3.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.82 0.343 . . . . 0.0 110.783 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 76.4 m -150.85 147.84 27.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.002 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.07 126.05 34.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.1 t -86.97 141.34 28.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.036 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.403 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.3 pt -47.23 -28.47 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.11 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -65.11 -14.28 60.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.2 40.24 4.31 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.998 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -152.48 139.91 19.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.167 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.4 m -75.06 172.94 11.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.28 -147.08 12.17 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.469 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 t -156.71 -170.85 3.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.909 0.385 . . . . 0.0 110.941 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.27 -160.38 46.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.5 -28.19 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 111.201 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.49 -35.26 79.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.234 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.419 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 89.8 m-85 -109.9 -29.95 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.8 t -124.06 53.24 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -90.78 -120.98 2.35 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.456 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.64 -43.67 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.923 0.392 . . . . 0.0 111.144 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.07 -12.05 18.95 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.718 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -103.81 27.07 7.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.711 0.291 . . . . 0.0 111.035 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 10.7 p -122.95 124.26 42.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.995 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -80.57 -56.46 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.867 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -136.8 162.42 33.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.931 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.22 46.19 6.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.614 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.5 t -104.28 -30.92 9.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.857 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.92 26.75 10.23 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.551 179.944 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.8 p -144.32 39.9 1.32 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.1 t -60.46 -31.63 70.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.936 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.21 -32.39 72.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.055 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 t -69.94 -22.3 63.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.167 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 75.6 mtm-85 -101.53 25.68 8.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -83.31 159.72 61.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.798 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -87.43 12.1 54.39 Favored 'Cis proline' 0 C--N 1.346 0.437 0 C-N-CA 123.472 -1.47 . . . . 0.0 112.802 0.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -126.45 65.61 59.97 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.751 0.31 . . . . 0.0 111.005 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -82.3 -43.0 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.685 2.256 . . . . 0.0 112.425 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.5 m -93.66 162.67 13.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.047 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.74 -169.84 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.762 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.89 128.92 34.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.036 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.97 -23.14 28.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.477 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.9 mp -117.36 146.37 43.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.79 0.329 . . . . 0.0 110.902 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 m -111.88 171.84 7.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.34 124.07 40.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.42 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . 22.1 p -87.75 138.62 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.947 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.407 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.6 pt -46.99 -29.88 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.077 -179.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.53 -14.11 60.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.214 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.9 41.07 3.91 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.101 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -155.97 146.24 21.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.839 0.352 . . . . 0.0 111.153 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.1 m -82.56 167.11 18.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.909 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.426 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 173.36 -152.37 15.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.577 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.8 p -149.21 -169.33 3.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.924 0.393 . . . . 0.0 111.045 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.66 -166.68 51.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.521 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.77 57.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.656 0.265 . . . . 0.0 111.455 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.16 -33.3 44.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.289 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.426 ' CD2' ' HA3' ' A' ' 24' ' ' GLY . 48.1 m-85 -110.7 -30.51 7.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.1 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 67.0 m -118.86 37.67 4.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.821 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -88.65 -142.43 8.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.06 37.95 4.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 0.0 111.075 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -170.97 -41.21 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.419 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -80.28 -23.59 40.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.737 0.303 . . . . 0.0 111.08 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 22.6 p -79.98 106.25 11.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.032 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.407 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 27.5 ttp180 -80.25 -44.9 18.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.107 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.56 154.96 41.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.94 0.4 . . . . 0.0 111.293 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 63.72 46.92 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.112 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -128.45 -41.98 1.51 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -84.89 -25.94 27.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.871 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.382 -1.232 . . . . 0.0 112.519 179.991 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.892 0 N-CA-C 112.324 0.491 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.9 p -131.57 43.56 3.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.788 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -95.54 -34.51 12.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.925 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.86 -40.25 96.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -26.34 66.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.474 ' HB3' ' HA ' ' A' ' 10' ' ' PRO . 2.7 mtt180 -79.87 -23.49 41.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.161 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -44.75 139.21 3.77 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -97.12 44.21 2.91 Favored 'Cis proline' 0 C--N 1.348 0.547 0 C-N-CA 124.388 -1.088 . . . . 0.0 113.21 0.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.438 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 2.3 mmt180 -143.42 51.99 1.89 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.638 0.256 . . . . 0.0 111.423 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.474 ' HA ' ' HB3' ' A' ' 6' ' ' ARG . 88.0 Cg_endo -82.78 -32.7 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.536 2.157 . . . . 0.0 112.565 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -141.36 171.09 14.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.63 -171.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.889 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.17 138.86 32.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.18 -28.22 12.43 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.471 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.98 161.71 13.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.807 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.4 m -133.13 163.69 28.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.0 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -100.96 128.51 46.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.711 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.5 p -90.05 143.08 27.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.227 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.436 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.4 pp -45.87 -37.5 2.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.101 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.875 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -56.42 -21.95 28.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.91 44.25 1.95 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.176 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -154.39 141.94 19.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.834 0.349 . . . . 0.0 111.191 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.81 168.94 18.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.818 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.466 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 170.51 -147.3 10.48 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.529 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -159.96 -176.65 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.4 -157.91 23.46 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.46 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -86.6 8.24 23.04 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.401 ' HB1' ' CD1' ' A' ' 29' ' ' TYR . . . -89.77 -36.41 15.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.806 0.336 . . . . 0.0 111.238 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.466 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 30.1 m-85 -127.87 1.14 6.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.673 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 t -125.33 -29.0 3.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.659 0.266 . . . . 0.0 111.296 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -56.3 176.75 0.87 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.773 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.16 154.06 42.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.341 . . . . 0.0 111.114 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 58.12 22.08 48.33 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.39 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -160.1 32.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.786 0.327 . . . . 0.0 110.709 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 44.5 t -141.26 118.21 11.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.098 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.436 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -87.56 -37.7 16.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.771 179.759 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.9 t -150.3 157.63 43.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.712 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 67.54 46.68 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.615 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.2 m -100.97 -32.51 10.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.813 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 -162.16 30.5 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.851 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.4 -1.222 . . . . 0.0 112.474 -179.969 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.9 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.1 p -140.44 48.4 1.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.729 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.4 p -85.28 -31.78 22.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.65 -50.87 70.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -179.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.36 -23.69 63.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.296 -179.773 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 25.95 9.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.267 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.425 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.16 164.71 26.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.711 179.916 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.425 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 90.5 Cg_endo -86.19 21.86 21.42 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.693 -1.378 . . . . 0.0 113.087 0.43 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.32 61.75 59.2 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.349 . . . . 0.0 110.829 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -86.32 -47.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.752 2.301 . . . . 0.0 112.813 -179.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.8 m -110.45 -178.59 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.889 0.376 . . . . 0.0 111.029 -179.734 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -63.9 -177.31 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.866 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 134.37 36.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.105 -179.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.83 -26.02 17.12 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -101.12 136.78 40.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.839 0.352 . . . . 0.0 110.956 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 30.3 m -104.57 161.81 13.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.851 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.9 t -97.79 106.34 18.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 p -67.1 139.9 57.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.83 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.4 pt -47.16 -33.77 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.797 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.84 -17.87 57.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.075 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.1 42.7 2.55 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.09 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -138.34 176.3 8.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 111.152 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -122.08 137.42 54.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.43 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -168.44 -158.87 12.97 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.548 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.6 p -142.31 -168.02 2.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.036 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.78 -169.88 19.76 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.511 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.2 -4.86 44.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.561 0.219 . . . . 0.0 111.582 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.93 -37.8 38.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.774 0.321 . . . . 0.0 111.24 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.43 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 66.7 m-85 -112.91 -28.06 7.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.385 -179.783 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.0 m -104.41 -23.1 13.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -57.51 155.33 19.04 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.617 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.56 145.86 37.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.804 0.335 . . . . 0.0 111.137 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.41 26.75 69.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.504 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -159.91 30.58 0.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.755 0.312 . . . . 0.0 110.921 -179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.26 125.71 11.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.991 -179.864 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.98 -58.42 3.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.854 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.411 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -131.67 168.45 17.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.877 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 62.94 46.81 4.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.808 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.34 -38.54 3.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.981 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -102.84 -31.67 10.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.431 -1.205 . . . . 0.0 112.529 -179.99 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.4 p . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.863 0.363 . . . . 1.6299999999999999 110.866 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -67.99 -50.75 53.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.02 110.973 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -29.84 59.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.92000000000000004 111.227 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -26.61 64.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 1.3300000000000001 111.034 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -102.79 26.67 7.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 3.4500000000000002 111.079 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.402 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.7 m -83.92 162.17 53.18 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.417 . . . . 1.1599999999999999 110.794 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 83.7 Cg_endo -81.79 0.87 48.11 Favored 'Cis proline' 0 C--N 1.346 0.413 0 C-N-CA 123.383 -1.507 . . . . 0.94999999999999996 112.857 0.027 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.99 70.0 3.71 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 120.773 0.32 . . . . 3.6699999999999999 111.009 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.79 -44.23 0.38 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.616 2.211 . . . . 0.68000000000000005 112.407 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 97.0 m -113.1 -178.25 3.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 1.3200000000000001 110.973 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.9 -172.81 2.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 2.0099999999999998 110.86 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.87 140.22 36.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.60999999999999999 111.06 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.85 -28.18 12.88 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.792 -0.718 . . . . 0.56999999999999995 112.448 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -106.48 158.59 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.825 0.345 . . . . 0.81000000000000005 110.82 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.3 m -128.03 150.6 49.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.5 110.929 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -87.38 126.39 34.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 1.03 110.862 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.3 t -92.46 137.32 32.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 1.28 110.865 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.482 HG22 ' HD3' ' A' ' 36' ' ' ARG . 1.4 pt -47.42 -31.34 2.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 0.70999999999999996 111.568 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -58.13 -21.85 48.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 2.0899999999999999 110.978 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 22' ' ' TYR . . . 104.92 39.18 2.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.722 -0.751 . . . . 0.58999999999999997 112.369 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 21' ' ' GLY . 74.8 m-85 -159.41 143.33 14.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.872 0.368 . . . . 1.5700000000000001 111.05 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.9 m -78.11 179.84 6.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.81000000000000005 110.814 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 160.57 -145.6 11.33 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.676 -0.773 . . . . 0.48999999999999999 112.57 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.91 -170.5 3.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.841 0.353 . . . . 1.4399999999999999 110.958 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.61 -160.52 28.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.48999999999999999 112.554 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.63 -28.76 28.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 0.55000000000000004 111.202 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.23 -35.04 72.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.48999999999999999 111.167 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 97.7 m-85 -112.77 -33.15 6.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.228 -0.442 . . . . 1.3300000000000001 111.066 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -115.21 44.47 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 1.24 110.909 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -103.34 162.48 15.9 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.713 -0.755 . . . . 1.0800000000000001 112.526 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.5 103.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.81 0.338 . . . . 1.8400000000000001 111.122 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.59 -23.19 32.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.694 -0.765 . . . . 1.0600000000000001 112.619 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -103.58 27.15 7.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.731 0.301 . . . . 1.25 110.968 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.6 p -137.41 124.27 21.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.357 -0.383 . . . . 1.1399999999999999 110.962 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.482 ' HD3' HG22 ' A' ' 19' ' ' ILE . 1.4 tpp180 -79.87 -37.84 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 2.1699999999999999 110.872 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 m -146.52 167.69 23.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.93000000000000005 110.942 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 61.84 46.11 7.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.8700000000000001 110.738 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.5 m . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.991 -0.549 . . . . 1.29 110.882 179.957 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.944 0.402 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 10' ' ' PRO . 23.9 p -69.88 -21.53 63.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.2 -31.67 65.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.839 0.352 . . . . 0.0 111.305 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.4 t -67.69 -19.4 65.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.455 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -112.34 31.57 6.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 111.283 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 m -69.01 162.22 66.72 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -91.63 8.77 62.54 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.845 -1.314 . . . . 0.0 112.909 0.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 -135.01 66.91 69.23 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.0 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 93.5 Cg_endo -83.36 -42.87 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.733 2.289 . . . . 0.0 112.483 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.75 179.22 7.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.952 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.33 -171.6 3.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.801 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.11 134.04 35.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.047 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.68 -26.07 23.67 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.474 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -112.14 140.08 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.83 0.348 . . . . 0.0 110.892 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 38' ' ' GLN . 18.0 m -108.85 166.82 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.768 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 3.8 m -102.55 124.45 48.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.985 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.1 t -83.97 143.49 29.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.576 HG22 ' HB2' ' A' ' 36' ' ' ARG . 2.3 pp -47.8 -27.67 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.061 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -71.79 -5.91 37.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.541 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.86 6.35 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -133.73 179.37 6.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.855 0.36 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.71 148.83 51.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.792 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.87 -137.06 2.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.616 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.9 t -155.34 -169.0 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.984 0.421 . . . . 0.0 110.975 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.83 -171.97 25.47 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.509 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.62 -9.88 59.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.559 0.219 . . . . 0.0 111.523 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.95 -37.0 56.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.8 0.333 . . . . 0.0 111.207 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -110.39 -27.4 9.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.112 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.3 m -111.37 29.92 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.989 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -108.01 159.27 14.46 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.517 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.15 119.98 16.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.123 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.2 -28.19 11.44 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -107.5 -27.91 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.787 0.327 . . . . 0.0 110.973 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 45.5 t -85.58 105.9 16.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.576 ' HB2' HG22 ' A' ' 19' ' ' ILE . 7.6 ttp180 -79.99 -47.8 14.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.264 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.23 160.95 33.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 111.268 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.417 ' HB3' ' HA ' ' A' ' 16' ' ' CYS . 1.8 tm0? 62.31 46.17 6.18 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.821 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 m . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.855 179.958 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.871 0.367 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.8 p -84.13 2.68 38.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.505 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.24 -30.35 68.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.786 0.327 . . . . 0.0 111.145 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 p -68.61 -22.05 64.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.317 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.15 29.93 6.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.798 0.332 . . . . 0.0 110.995 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.438 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.24 164.27 53.1 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.823 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 6.5 Cg_endo -87.52 4.06 69.21 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 124.064 -1.223 . . . . 0.0 112.859 0.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -127.64 69.54 75.88 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 120.924 0.392 . . . . 0.0 110.907 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -81.03 -43.2 0.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.622 2.215 . . . . 0.0 112.396 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 51.5 m -85.74 162.14 18.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -63.93 -173.59 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.13 134.3 36.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.075 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 105.83 -26.17 21.81 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.498 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.417 HD23 ' O ' ' A' ' 24' ' ' GLY . 2.6 mp -105.17 169.32 8.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.33 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 m -146.21 150.25 35.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -87.26 126.16 34.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.29 142.64 30.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.066 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.441 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.3 pt -47.17 -32.01 2.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.828 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -61.75 -18.41 59.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.083 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.81 40.21 2.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.064 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -139.38 -176.58 4.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 110.94 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.4 t -132.5 155.59 48.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.417 ' O ' HD23 ' A' ' 15' ' ' LEU . . . 173.91 -132.28 2.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.547 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.07 -172.01 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.857 0.36 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.41 -160.21 46.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.46 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.91 -29.55 29.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.784 0.326 . . . . 0.0 111.099 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.05 79.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.227 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -108.18 -29.73 8.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.007 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 2.0 t -120.38 39.53 3.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.098 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.62 171.79 53.01 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.352 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.46 65.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.897 0.38 . . . . 0.0 111.038 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.14 28.54 7.21 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.345 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -148.78 28.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.789 0.328 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.1 p -124.6 123.14 39.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.2 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.441 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.5 tpp180 -79.93 -41.8 25.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.48 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 m -151.61 161.23 43.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.45 46.43 5.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.021 0.439 . . . . 0.0 110.617 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 59.9 m . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.913 179.894 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.406 ' HG1' ' HB2' ' A' ' 5' ' ' SER . 2.9 t . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.878 0.37 . . . . 0.0 110.92 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.1 p -65.54 -25.45 67.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.038 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.72 -35.32 74.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.406 ' HB2' ' HG1' ' A' ' 2' ' ' THR . 19.5 m -64.59 -15.9 61.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.734 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -123.34 37.94 4.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.669 0.271 . . . . 0.0 111.374 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.9 m -74.17 160.05 82.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.767 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -89.65 6.83 68.34 Favored 'Cis proline' 0 N--CA 1.46 -0.482 0 C-N-CA 123.576 -1.426 . . . . 0.0 112.753 0.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 77.52 62.24 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.51 -30.29 2.55 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.603 2.202 . . . . 0.0 112.616 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.1 m -115.08 175.28 5.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.053 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -63.45 -170.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.923 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 133.6 36.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.76 -26.35 18.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.44 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.452 ' O ' ' NE2' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -88.93 165.11 14.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.801 0.334 . . . . 0.0 110.835 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.6 m -143.07 149.66 38.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.11 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.1 t -90.37 109.04 20.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.527 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.4 p -74.44 140.03 44.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.108 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.51 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.0 pp -46.98 -34.36 2.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.87 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -59.64 -19.4 48.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.067 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.21 41.02 2.68 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.044 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -137.27 173.98 11.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.9 0.381 . . . . 0.0 111.02 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.25 129.03 49.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.841 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -162.62 -145.17 4.25 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.483 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -142.79 -172.98 3.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.81 -162.43 11.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.464 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.73 -26.2 54.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.77 0.319 . . . . 0.0 111.26 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.53 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.342 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.0 m-85 -127.43 5.57 6.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -150.65 30.52 0.66 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.878 0.37 . . . . 0.0 110.924 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.07 -171.6 47.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.544 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -76.83 -32.23 57.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.67 16.63 12.39 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.667 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -141.73 33.83 1.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.786 0.327 . . . . 0.0 110.75 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.9 t -136.22 104.33 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.198 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.51 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.5 OUTLIER -79.92 -52.58 7.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.719 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.48 164.2 21.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.452 ' NE2' ' O ' ' A' ' 15' ' ' LEU . 1.7 tt0 61.37 45.86 8.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.3 m . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.925 -179.992 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.792 0.33 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.56 -48.52 74.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.11 -37.6 85.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.125 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 m -68.78 -28.73 67.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.063 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.61 28.06 7.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.018 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.412 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 3.4 m -90.0 162.63 34.8 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.851 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.412 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 80.6 Cg_endo -89.21 17.31 41.46 Favored 'Cis proline' 0 C--N 1.347 0.466 0 C-N-CA 123.66 -1.392 . . . . 0.0 112.893 0.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -129.32 63.4 67.39 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.922 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -82.84 -43.01 0.09 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.693 2.262 . . . . 0.0 112.357 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.2 m -94.62 163.68 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -74.05 -173.33 1.58 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.08 133.37 36.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.08 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 -25.68 25.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.54 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -109.49 137.46 47.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.355 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 74.6 m -107.73 151.09 26.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.1 119.6 33.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.046 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.434 ' HB2' ' CD2' ' A' ' 29' ' ' TYR . 0.4 OUTLIER -77.98 146.18 35.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.702 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.461 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.9 pt -44.58 -30.18 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.033 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.405 ' N ' HG13 ' A' ' 19' ' ' ILE . 2.8 m-85 -59.91 -18.98 49.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.957 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.21 41.96 3.35 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.044 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -150.56 144.35 25.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.928 0.394 . . . . 0.0 111.404 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 m -79.67 158.2 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.917 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.421 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . -178.89 -139.36 3.53 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.563 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.01 -170.93 3.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 0.0 110.97 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.34 -166.71 10.85 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.542 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.18 -27.34 47.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.795 0.331 . . . . 0.0 111.184 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.14 73.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.128 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.434 ' CD2' ' HB2' ' A' ' 18' ' ' SER . 10.8 m-85 -109.54 -27.4 9.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.004 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.4 t -122.18 48.29 1.76 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -122.54 159.22 17.19 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.498 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.15 116.48 3.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.791 0.329 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.19 -16.69 45.4 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.662 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.416 ' HA ' HG12 ' A' ' 19' ' ' ILE . 50.8 m-20 -132.11 44.12 2.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.881 0.372 . . . . 0.0 110.843 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.1 t -127.2 105.8 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.107 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.461 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -79.79 -57.53 3.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.792 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.5 m -143.88 169.5 17.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.876 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 61.86 46.16 7.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.993 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.837 0.351 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.403 ' HB2' ' CB ' ' A' ' 10' ' ' PRO . 7.5 p -62.41 -30.91 71.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.04 -39.19 74.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.297 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 t -70.32 -21.04 62.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.215 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -97.24 23.07 7.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.148 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.5 m -70.52 161.09 78.92 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.832 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -84.71 1.37 62.02 Favored 'Cis proline' 0 C--N 1.347 0.469 0 C-N-CA 123.475 -1.469 . . . . 0.0 112.862 0.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -126.5 76.75 73.66 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.768 0.318 . . . . 0.0 110.967 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.403 ' CB ' ' HB2' ' A' ' 3' ' ' CYS . 16.0 Cg_exo -67.98 -66.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.746 2.298 . . . . 0.0 112.337 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.1 m -95.95 179.77 4.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.039 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.39 -170.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.952 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.96 137.03 36.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.005 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.14 -28.23 12.46 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.446 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.04 169.81 9.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.8 0.333 . . . . 0.0 110.853 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 m -141.97 150.35 41.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 43.1 t -98.22 108.22 20.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.25 137.52 46.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.478 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.0 pt -46.11 -33.19 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.903 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.54 -20.31 45.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.019 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 101.18 41.91 2.5 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.142 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 6.5 m-85 -148.01 146.49 28.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 111.171 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -91.65 152.77 20.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.773 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.27 -144.62 5.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.577 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.0 t -157.45 -169.87 3.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.834 0.349 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.35 -167.56 18.17 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.511 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.62 -12.25 60.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.686 0.279 . . . . 0.0 111.525 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.75 -34.31 66.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.791 0.329 . . . . 0.0 111.194 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -116.74 -21.02 9.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.515 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 -12.16 14.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.669 -0.242 . . . . 0.0 111.477 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.7 162.85 44.57 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.497 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.58 149.86 49.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.834 0.349 . . . . 0.0 111.121 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.29 24.15 58.62 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.527 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -160.06 39.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.9 p -159.97 120.29 2.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.078 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.478 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 9.5 ttm180 -79.82 -56.92 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.3 m -123.85 165.81 16.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.42 46.97 4.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.862 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.921 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.3 p . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.823 0.344 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.2 t -74.66 -43.69 54.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.518 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -63.2 -40.32 97.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.131 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.1 m -70.16 -23.85 63.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.275 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -98.07 23.66 7.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.115 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.3 m -78.89 161.52 68.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.636 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -87.46 4.34 69.15 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.706 -1.372 . . . . 0.0 112.987 0.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.32 73.67 67.47 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 0.0 111.085 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HG3' ' HB2' ' A' ' 17' ' ' CYS . 72.7 Cg_endo -76.85 -42.97 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.565 2.177 . . . . 0.0 112.243 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.9 m -114.03 176.9 4.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.971 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.48 -174.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.969 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 146.76 31.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.93 -25.18 28.27 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.47 154.23 20.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.816 0.341 . . . . 0.0 110.905 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.9 m -120.03 150.56 40.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.963 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.414 ' HB2' ' HG3' ' A' ' 10' ' ' PRO . 18.4 t -84.56 113.7 21.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.998 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.44 137.64 37.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.759 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 29.5 pt -45.72 -37.0 2.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.824 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -56.54 -22.43 33.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.965 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 103.93 41.04 2.19 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.184 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.408 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 20.7 m-85 -153.67 143.03 21.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.817 0.342 . . . . 0.0 111.149 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.52 169.44 18.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.435 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 168.07 -150.42 16.4 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.417 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -152.44 -169.49 3.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.935 0.398 . . . . 0.0 111.004 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.19 -160.2 35.76 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.5 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.78 -30.6 26.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.859 0.361 . . . . 0.0 111.16 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -35.62 72.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.435 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 53.2 m-85 -110.63 -28.5 8.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.042 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 47.55 2.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 110.952 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -104.02 165.27 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.436 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.28 92.59 1.04 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 111.102 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.0 16.03 14.76 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.651 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -137.05 12.8 3.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.607 0.241 . . . . 0.0 111.232 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.3 p -127.43 137.98 52.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 110.864 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.518 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -79.97 -53.52 6.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.945 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 p -149.55 169.03 21.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.52 47.73 2.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.792 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.6 m . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.953 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.917 0.389 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 t -64.88 -47.64 77.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.974 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.41 86.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.128 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -22.75 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.093 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 28.32 7.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.806 0.336 . . . . 0.0 111.059 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.404 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.77 162.88 58.6 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.778 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.404 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 81.2 Cg_endo -89.62 14.12 51.11 Favored 'Cis proline' 0 C--N 1.347 0.497 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.819 0.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.28 63.42 67.39 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.808 0.337 . . . . 0.0 110.972 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -84.12 -44.06 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.726 2.284 . . . . 0.0 112.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.455 ' HB3' HD12 ' A' ' 15' ' ' LEU . 56.3 m -82.08 154.6 25.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.898 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.4 -170.85 0.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.832 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.84 120.29 24.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.99 -12.27 17.39 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.765 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.455 HD12 ' HB3' ' A' ' 11' ' ' CYS . 0.0 OUTLIER -134.35 139.57 45.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -92.94 -178.1 4.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.0 t -113.51 123.22 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.789 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.2 p -83.93 145.8 28.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.402 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.536 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.8 pt -46.66 -27.18 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.105 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.085 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.401 ' N ' HG13 ' A' ' 19' ' ' ILE . 20.6 m-85 -75.0 0.65 15.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.607 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.96 37.59 18.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.017 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -129.6 178.41 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 111.053 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.403 ' O ' ' CE1' ' A' ' 29' ' ' TYR . 71.1 m -126.79 157.86 38.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.85 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.408 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 169.84 -147.89 11.31 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.623 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.16 -168.01 2.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.967 0.413 . . . . 0.0 111.046 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.35 -165.79 26.82 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.521 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 -27.48 54.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.789 0.328 . . . . 0.0 111.112 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.51 75.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.408 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 88.0 m-85 -107.58 -30.19 8.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.109 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.4 m -115.09 38.92 3.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.987 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.49 -166.99 40.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.439 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.38 -35.7 14.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.893 0.378 . . . . 0.0 111.155 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.67 23.46 29.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.494 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -153.98 43.96 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 7.6 t -125.54 102.79 7.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.041 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.536 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 2.9 tpt180 -79.84 -46.25 17.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.825 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.3 m -150.1 168.38 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 62.48 46.15 5.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.813 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.7 m . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.927 179.972 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.8 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.909 0.385 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 t -86.35 -49.07 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.968 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.91 71.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.191 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.6 -27.43 66.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.065 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.95 28.99 7.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.972 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.416 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.8 m -89.97 163.03 33.71 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.741 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 76.9 Cg_endo -87.81 4.84 69.33 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.655 -1.394 . . . . 0.0 112.907 0.111 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -120.84 66.9 14.28 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.362 . . . . 0.0 111.113 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -77.58 -43.33 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.58 2.187 . . . . 0.0 112.481 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.0 m -105.87 171.7 7.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.06 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.9 -170.02 2.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.935 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.92 134.04 36.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.011 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.07 -26.79 9.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.367 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -114.63 147.38 39.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.869 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -119.95 146.35 45.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.858 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.5 t -85.13 119.18 25.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.744 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.8 t -77.76 145.27 36.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.4 pt -46.79 -26.01 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.104 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.45 9.74 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.532 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.8 44.76 37.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.621 -0.8 . . . . 0.0 112.278 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -145.52 122.17 11.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.809 0.338 . . . . 0.0 111.205 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -73.3 170.04 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.775 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.426 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 158.66 -152.7 23.83 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.596 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.5 p -145.11 -168.21 2.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.391 . . . . 0.0 111.06 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.33 -169.94 42.87 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.39 -16.35 58.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.682 0.277 . . . . 0.0 111.435 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.03 -34.02 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.759 0.314 . . . . 0.0 111.309 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.426 ' CD2' ' HA3' ' A' ' 24' ' ' GLY . 74.1 m-85 -107.96 -33.66 7.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.204 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.7 m -108.71 28.2 8.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.044 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -79.73 -174.84 47.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.557 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.35 -33.01 16.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.35 . . . . 0.0 111.066 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.55 19.66 44.34 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.602 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -152.79 48.45 0.73 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.362 . . . . 0.0 110.726 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.3 t -126.35 103.32 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -79.89 -54.79 5.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.7 m -138.56 170.31 16.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.943 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.39 47.37 3.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.0 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.894 0.378 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 19.4 p -79.67 -21.03 45.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.186 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.624 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -53.87 -26.38 24.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.728 0.299 . . . . 0.0 111.389 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.6 p -74.24 -14.48 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.523 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -96.02 9.62 40.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.573 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.27 144.16 83.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.428 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -95.78 26.85 19.38 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.315 -1.119 . . . . 0.0 112.968 0.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.474 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 11.8 mtm-85 -130.82 53.4 11.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.662 0.268 . . . . 0.0 111.355 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.482 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 95.6 Cg_endo -84.9 -43.59 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.573 2.182 . . . . 0.0 112.714 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 t -100.0 170.75 8.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.107 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -81.8 -174.63 5.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.02 129.37 34.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.096 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.7 -22.41 37.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.616 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.6 166.52 11.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 110.981 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -132.98 155.04 49.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.765 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.63 103.69 16.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.844 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.49 140.56 56.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.001 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.407 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.1 pp -45.87 -39.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.806 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.407 ' N ' HD12 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -56.61 -22.41 33.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.988 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.89 45.93 1.44 Allowed Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.119 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -152.77 133.03 13.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.158 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.25 162.18 28.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.843 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 168.52 -159.44 32.6 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.53 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -144.81 -177.37 5.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.796 0.332 . . . . 0.0 110.846 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.62 -169.87 8.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.3 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.51 -15.88 61.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.61 0.243 . . . . 0.0 111.371 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.57 78.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.717 0.294 . . . . 0.0 111.414 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -133.37 17.0 4.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.4 t -160.08 30.2 0.17 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.05 176.93 32.26 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.502 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.12 109.28 2.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.823 0.344 . . . . 0.0 111.075 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.23 -23.06 37.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.617 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -107.94 29.93 6.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.813 0.34 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.7 t -129.04 118.22 22.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.624 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 0.9 OUTLIER -81.02 -64.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.966 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.406 ' CB ' ' HG3' ' A' ' 10' ' ' PRO . 80.6 m -127.4 163.84 23.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.872 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.4 46.68 4.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.82 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 m . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.938 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.954 0.407 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -73.64 -40.89 63.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.33 -32.63 74.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.145 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 -26.44 65.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.037 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 mtp180 -106.22 28.98 7.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.958 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.444 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.3 m -85.03 164.7 40.53 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.444 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 79.0 Cg_endo -86.67 2.84 68.1 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.65 -1.396 . . . . 0.0 112.915 0.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -124.34 68.96 50.49 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.98 -27.28 2.55 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.617 2.211 . . . . 0.0 112.579 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -109.2 171.72 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.072 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -71.58 -174.22 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 133.46 36.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.97 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.82 -26.82 11.08 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.336 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.8 170.29 7.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.749 0.309 . . . . 0.0 110.803 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.2 m -141.62 161.33 38.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.933 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.7 t -93.72 132.74 37.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.088 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -93.68 138.4 31.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.891 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.443 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.2 pp -45.69 -38.12 2.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.819 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.443 ' N ' HD12 ' A' ' 19' ' ' ILE . 99.1 m-85 -57.0 -22.16 36.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.074 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.05 41.41 2.11 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.072 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -154.27 141.01 19.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.854 0.359 . . . . 0.0 111.034 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -74.18 175.57 7.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.899 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.418 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.2 -146.65 11.68 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.427 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 m -155.49 -170.89 3.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.886 0.374 . . . . 0.0 110.967 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.16 -160.91 42.16 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.441 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.58 -29.93 25.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.737 0.303 . . . . 0.0 111.087 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.15 -36.31 79.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.208 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.418 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 79.2 m-85 -108.12 -29.77 8.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.008 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 5.0 t -126.33 48.83 2.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.96 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.64 -146.34 19.69 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.411 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -119.98 76.16 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 111.038 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.05 -27.94 3.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.401 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -98.08 21.74 10.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.675 0.274 . . . . 0.0 111.042 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 19.6 p -120.22 135.31 55.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.35 . . . . 0.0 110.913 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.409 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.2 OUTLIER -79.97 -39.94 29.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.866 179.924 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.8 m -148.75 166.12 29.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.28 46.75 2.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.8 m . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.963 179.862 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.9 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.922 0.391 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.7 t -78.51 -32.73 48.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.903 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.21 86.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.058 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -70.26 -22.71 62.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.02 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.1 mtp180 -79.92 -21.47 43.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.134 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.2 m -52.68 160.24 1.47 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.951 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -90.35 18.75 38.3 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.897 0.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.18 66.32 45.28 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.748 0.309 . . . . 0.0 111.231 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -71.85 -42.73 1.51 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.771 2.314 . . . . 0.0 112.261 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.8 m -122.15 172.17 8.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.103 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 140.03 36.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.045 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.28 -27.95 14.17 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.432 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.78 171.77 8.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.813 0.34 . . . . 0.0 110.916 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.6 m -146.89 159.37 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.836 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.2 t -98.33 127.28 44.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 t -88.91 139.34 30.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 21.1 pt -46.01 -36.72 2.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.823 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -19.66 29.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.083 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.77 46.53 1.92 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.112 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -154.13 142.99 21.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.915 0.388 . . . . 0.0 111.283 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.4 ' O ' ' CD2' ' A' ' 29' ' ' TYR . 0.5 OUTLIER -81.59 170.66 15.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.797 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.437 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 159.81 -150.27 20.45 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.578 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.1 t -148.42 -170.06 3.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.912 0.386 . . . . 0.0 110.994 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.39 -157.14 37.42 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.516 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.48 -26.76 29.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 0.0 111.194 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.26 75.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.17 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.437 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 34.2 m-85 -116.56 -17.96 10.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.447 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -129.81 32.25 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.761 0.315 . . . . 0.0 110.958 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.15 177.52 39.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.506 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.67 132.12 42.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.86 0.362 . . . . 0.0 111.14 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.19 24.56 58.88 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.468 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -143.28 23.48 1.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 111.134 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.2 p -131.36 125.73 33.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.015 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -43.95 21.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.974 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -136.34 167.66 20.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.961 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 61.64 45.82 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.793 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.1 m . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.875 179.917 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.2 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.007 0.432 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.8 m -49.38 -54.73 15.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.231 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -52.8 -41.71 64.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.241 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.8 t -67.26 -27.39 67.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.032 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.3 mtm105 -118.41 30.07 7.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.04 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.429 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.6 m -84.98 164.2 42.75 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.726 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 72.6 Cg_endo -89.83 19.98 33.94 Favored 'Cis proline' 0 C--N 1.347 0.495 0 C-N-CA 123.791 -1.337 . . . . 0.0 112.936 0.32 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.414 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 31.8 mtp180 -137.59 64.82 45.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.701 0.286 . . . . 0.0 111.199 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 17.3 Cg_exo -67.1 -51.66 0.75 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.585 2.19 . . . . 0.0 112.104 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.03 -177.06 4.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -72.43 -174.99 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 139.96 35.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.113 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.72 -25.25 28.14 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.448 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -108.36 144.06 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.831 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.3 m -108.58 139.78 42.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.744 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.88 106.37 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 35' ' ' CYS . 18.8 p -66.24 140.82 58.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.034 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 34' ' ' ASN . 2.3 pp -48.12 -33.71 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.655 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -56.71 -22.87 38.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.032 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.27 41.44 1.78 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.38 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -158.81 134.51 8.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.838 0.351 . . . . 0.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.67 152.12 20.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 29' ' ' TYR . . . -174.43 -136.37 2.23 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.484 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -147.92 -169.9 3.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.915 0.388 . . . . 0.0 110.919 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 -161.38 45.59 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.499 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.25 -25.87 36.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.771 0.32 . . . . 0.0 111.219 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.31 80.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.239 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.436 ' CD2' ' N ' ' A' ' 24' ' ' GLY . 54.3 m-85 -108.91 -37.97 5.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.073 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 77.8 m -114.04 47.97 1.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.949 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.67 -155.75 30.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.478 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.7 115.32 29.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.856 0.36 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.06 10.7 86.03 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.764 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.445 ' O ' HG23 ' A' ' 19' ' ' ILE . 39.7 m-20 -113.33 -29.92 7.08 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.783 0.325 . . . . 0.0 110.971 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 18' ' ' SER . 28.1 p -83.78 129.1 34.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.106 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.443 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.7 ttp180 -79.72 -54.47 5.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.813 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 17.3 m -127.9 163.01 25.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 62.45 46.72 5.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.778 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.987 -179.989 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.846 0.355 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -65.45 -47.83 74.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.983 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.665 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -58.11 -21.95 48.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.335 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.56 -22.06 63.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.293 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -103.56 25.71 9.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.778 0.323 . . . . 0.0 111.312 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.76 142.46 91.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.341 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -97.53 22.11 25.58 Favored 'Cis proline' 0 N--CA 1.457 -0.623 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.066 0.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 65.28 69.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 0.0 111.405 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.24 -26.8 3.97 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.599 2.199 . . . . 0.0 112.435 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 m -137.01 -179.82 5.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.0 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.85 -171.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.979 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.01 135.36 36.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.014 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.03 -27.31 17.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.62 122.18 46.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.859 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.2 m -97.82 159.56 14.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.901 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 48.8 t -94.7 118.45 31.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.7 t -80.04 139.6 36.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.045 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.409 HG22 ' HG3' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -45.6 -32.04 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.651 -179.9 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -22.37 34.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.71 37.21 3.05 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.22 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -156.08 144.4 19.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 68.2 m -74.58 175.07 8.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.898 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.416 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 166.36 -148.51 13.64 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.474 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 78.8 p -150.57 -170.52 3.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.75 -164.09 17.64 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.53 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.87 -29.19 32.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.796 0.332 . . . . 0.0 111.173 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.6 72.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.18 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.416 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.9 m-85 -109.82 -28.53 8.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 t -127.7 50.44 2.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.884 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -125.53 170.47 17.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.531 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.15 124.87 21.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 111.092 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.66 2.49 85.5 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -137.68 37.41 2.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.2 p -143.66 110.89 5.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.665 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 4.2 ttt180 -80.22 -62.93 1.53 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 80.0 m -118.95 157.58 27.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.9 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 62.24 46.42 6.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.794 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.5 t . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.964 179.951 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.878 0.37 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 6.4 p -62.23 -26.11 68.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.254 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.58 -31.11 66.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.0 p -70.67 -12.66 61.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.704 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -110.04 25.12 12.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.683 0.278 . . . . 0.0 111.425 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.439 ' SG ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -64.11 148.52 95.34 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.323 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 71.2 Cg_endo -98.31 20.35 26.1 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.432 -1.07 . . . . 0.0 113.081 0.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -137.06 67.33 55.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.749 0.309 . . . . 0.0 111.033 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.46 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 85.6 Cg_endo -83.59 -44.48 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.596 2.197 . . . . 0.0 112.695 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 m -109.04 166.46 10.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -67.83 -171.22 0.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.796 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 128.64 33.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.095 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 113.49 -22.52 15.05 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.611 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -109.7 169.18 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.84 0.352 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.2 m -140.24 178.0 7.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.931 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.42 ' HB3' ' HB2' ' A' ' 37' ' ' CYS . 39.7 t -112.9 118.45 34.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.813 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.6 p -87.63 137.5 32.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.113 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.656 HG22 ' HD3' ' A' ' 36' ' ' ARG . 1.9 pp -46.88 -32.15 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.69 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -56.73 -21.57 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.967 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.17 42.44 2.23 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.162 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -149.09 175.6 11.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.166 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.2 t -116.84 157.17 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.427 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 173.91 -149.13 10.58 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.485 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.8 m -147.04 -170.02 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.897 0.38 . . . . 0.0 111.0 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.08 -160.04 22.26 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.95 -24.34 38.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.76 0.314 . . . . 0.0 111.237 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.69 -37.14 75.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.159 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.427 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 83.7 m-85 -114.98 -34.34 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.022 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.66 42.96 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.924 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -113.97 -167.0 16.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.509 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.61 107.48 19.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.844 0.354 . . . . 0.0 111.063 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.06 -17.06 24.9 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.736 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -130.09 42.61 3.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.896 0.379 . . . . 0.0 110.904 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 t -146.54 107.72 4.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.656 ' HD3' HG22 ' A' ' 19' ' ' ILE . 0.5 OUTLIER -87.55 -50.68 6.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.051 179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.42 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 26.9 m -123.42 157.24 33.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 62.51 46.82 5.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.909 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 34.1 m . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.912 179.966 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.7 p . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.895 0.379 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.62 -55.27 28.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.075 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.52 -36.09 63.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.325 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -68.86 -25.5 64.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.05 28.47 8.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.146 -179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 m -90.09 161.78 36.97 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.756 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -89.72 22.79 25.96 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.871 0.283 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.1 60.29 50.21 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.969 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -85.82 -46.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.762 2.308 . . . . 0.0 112.626 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.9 m -83.38 175.11 10.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.959 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -79.21 -175.68 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.89 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 131.78 35.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.082 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.35 -24.87 29.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.486 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -107.13 164.58 12.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -123.4 -170.44 2.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 37.8 t -123.77 131.0 53.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.034 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.96 143.12 26.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.918 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.642 HG23 ' O ' ' A' ' 34' ' ' ASN . 1.5 pt -47.53 -28.53 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.816 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.19 -20.62 42.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.917 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 41.23 2.53 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.222 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -151.72 -175.92 5.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 47.8 m -122.48 164.18 18.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.744 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 176.14 -145.41 7.54 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.564 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.12 -170.42 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.868 0.366 . . . . 0.0 110.958 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.81 -173.9 25.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.511 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.43 -15.31 61.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.661 0.267 . . . . 0.0 111.45 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.4 -35.29 63.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.79 0.329 . . . . 0.0 111.393 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 85.5 m-85 -107.41 -31.29 8.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.171 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.4 m -108.67 26.45 10.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.044 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -64.13 -149.18 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.359 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.83 -36.34 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.372 . . . . 0.0 111.201 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.3 -20.61 5.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.744 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' ' 19' ' ' ILE . 81.0 m-20 -79.88 -30.52 40.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.784 0.326 . . . . 0.0 111.017 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 27.6 p -82.93 127.93 33.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.504 ' HB2' HG22 ' A' ' 19' ' ' ILE . 22.0 ttp180 -92.3 -37.38 12.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.044 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.49 153.18 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.893 0.377 . . . . 0.0 111.013 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 63.0 47.35 4.32 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.827 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.984 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.824 0.345 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.1 p -55.84 -25.57 42.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.288 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.738 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -61.85 -37.4 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.893 0.378 . . . . 0.0 111.131 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.93 -25.58 62.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.212 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -103.1 21.4 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.394 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.439 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.18 164.36 28.01 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.615 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 97.6 Cg_endo -85.23 25.87 11.7 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 123.745 -1.356 . . . . 0.0 113.278 0.513 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.03 60.49 45.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.523 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 88.8 Cg_endo -85.69 -45.07 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.828 2.352 . . . . 0.0 112.821 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.9 m -119.56 176.58 5.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.011 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -169.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.756 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.91 128.4 33.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.061 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -23.26 11.54 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.399 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -110.78 138.95 46.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.826 0.346 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.5 m -118.21 169.09 9.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.893 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 49.0 t -97.01 117.06 30.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.954 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 p -76.9 139.31 40.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.055 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.458 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.3 pp -46.25 -39.11 3.49 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.088 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.838 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.458 ' N ' HD12 ' A' ' 19' ' ' ILE . 1.9 m-85 -57.82 -21.13 40.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.977 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.62 46.12 1.56 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.166 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -153.52 137.5 16.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 111.181 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -77.03 158.56 30.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.778 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 172.78 -165.76 38.23 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.569 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.4 m -129.32 -170.25 2.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.83 -174.1 4.44 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.98 -24.8 58.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.79 0.329 . . . . 0.0 111.218 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.6 77.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.231 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -119.55 0.37 11.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.53 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.7 t -152.65 35.89 0.5 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.814 0.34 . . . . 0.0 110.842 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.71 171.68 16.19 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.7 116.38 4.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.792 0.329 . . . . 0.0 111.14 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.03 -24.42 18.86 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.614 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -131.01 42.96 3.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.854 0.359 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 53.6 t -128.12 106.81 9.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.096 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.738 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 14.3 ttt180 -79.92 -58.9 2.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.6 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.37 170.07 17.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.609 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.74 45.33 7.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.74 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.091 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.88 0.371 . . . . 0.0 110.808 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.7 t -73.14 -56.86 4.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.079 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.81 -35.91 64.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.287 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.93 -26.61 64.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mtm-85 -107.94 23.94 13.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.282 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -90.18 160.39 40.18 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.8 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -87.69 28.71 11.3 Favored 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 123.631 -1.404 . . . . 0.0 112.925 0.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.59 57.3 27.64 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 0.0 110.823 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -82.22 -31.52 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.638 2.225 . . . . 0.0 112.464 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.13 175.83 5.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.125 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -96.87 -170.91 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.81 123.18 27.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.919 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.07 -20.08 24.31 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.359 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -114.41 179.61 3.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.82 0.343 . . . . 0.0 110.783 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 76.4 m -150.85 147.84 27.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.002 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.07 126.05 34.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.1 t -86.97 141.34 28.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.036 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.427 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.3 pt -47.23 -28.47 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.11 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -65.11 -14.28 60.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.2 40.24 4.31 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.998 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -152.48 139.91 19.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.167 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.4 m -75.06 172.94 11.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.42 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.28 -147.08 12.17 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.469 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 t -156.71 -170.85 3.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.909 0.385 . . . . 0.0 110.941 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.27 -160.38 46.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.5 -28.19 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 111.201 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.49 -35.26 79.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.234 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.42 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 89.8 m-85 -109.9 -29.95 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.8 t -124.06 53.24 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -90.78 -120.98 2.35 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.456 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.64 -43.67 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.923 0.392 . . . . 0.0 111.144 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.07 -12.05 18.95 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.718 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -103.81 27.07 7.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.711 0.291 . . . . 0.0 111.035 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 10.7 p -122.95 124.26 42.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.995 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -80.57 -56.46 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.867 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -136.8 162.42 33.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.931 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.22 46.19 6.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.614 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.5 t . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.857 179.906 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.8 p . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.885 0.374 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.1 t -60.46 -31.63 70.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.936 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.21 -32.39 72.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.055 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 t -69.94 -22.3 63.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.167 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 75.6 mtm-85 -101.53 25.68 8.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -83.31 159.72 61.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.798 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -87.43 12.1 54.39 Favored 'Cis proline' 0 C--N 1.346 0.437 0 C-N-CA 123.472 -1.47 . . . . 0.0 112.802 0.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -126.45 65.61 59.97 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.751 0.31 . . . . 0.0 111.005 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -82.3 -43.0 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.685 2.256 . . . . 0.0 112.425 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.5 m -93.66 162.67 13.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.047 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.74 -169.84 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.762 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.89 128.92 34.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.036 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.97 -23.14 28.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.477 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.499 ' N ' HD12 ' A' ' 15' ' ' LEU . 1.9 mp -117.36 146.37 43.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.79 0.329 . . . . 0.0 110.902 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 m -111.88 171.84 7.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.34 124.07 40.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.428 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . 22.1 p -87.75 138.62 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.947 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.682 HG22 ' HB2' ' A' ' 36' ' ' ARG . 2.6 pt -46.99 -29.88 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.077 -179.541 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.401 ' N ' HG13 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -65.53 -14.11 60.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.214 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.9 41.07 3.91 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.101 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -155.97 146.24 21.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.839 0.352 . . . . 0.0 111.153 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.1 m -82.56 167.11 18.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.909 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.426 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 173.36 -152.37 15.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.577 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.8 p -149.21 -169.33 3.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.924 0.393 . . . . 0.0 111.045 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.66 -166.68 51.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.521 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.77 57.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.656 0.265 . . . . 0.0 111.455 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.16 -33.3 44.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.289 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.428 ' CD2' ' HB3' ' A' ' 18' ' ' SER . 48.1 m-85 -110.7 -30.51 7.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.1 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 67.0 m -118.86 37.67 4.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.821 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -88.65 -142.43 8.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.06 37.95 4.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 0.0 111.075 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -170.97 -41.21 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.419 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.515 ' O ' HG23 ' A' ' 19' ' ' ILE . 81.0 m-20 -80.28 -23.59 40.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.737 0.303 . . . . 0.0 111.08 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 22.6 p -79.98 106.25 11.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.032 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.682 ' HB2' HG22 ' A' ' 19' ' ' ILE . 27.5 ttp180 -80.25 -44.9 18.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.107 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.56 154.96 41.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.94 0.4 . . . . 0.0 111.293 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.44 ' O ' ' NE2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 63.72 46.92 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.112 179.808 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.906 0.384 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -95.54 -34.51 12.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.925 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.86 -40.25 96.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -26.34 66.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.413 ' HB3' ' HA ' ' A' ' 10' ' ' PRO . 2.7 mtt180 -79.87 -23.49 41.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.161 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -44.75 139.21 3.77 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -97.12 44.21 2.91 Favored 'Cis proline' 0 C--N 1.348 0.547 0 C-N-CA 124.388 -1.088 . . . . 0.0 113.21 0.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.457 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 2.3 mmt180 -143.42 51.99 1.89 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.638 0.256 . . . . 0.0 111.423 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.457 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 88.0 Cg_endo -82.78 -32.7 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.536 2.157 . . . . 0.0 112.565 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -141.36 171.09 14.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.63 -171.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.889 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.17 138.86 32.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.18 -28.22 12.43 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.471 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.725 HD23 ' O ' ' A' ' 24' ' ' GLY . 0.8 OUTLIER -97.98 161.71 13.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.807 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.4 m -133.13 163.69 28.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.0 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -100.96 128.51 46.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.711 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.5 p -90.05 143.08 27.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.227 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.488 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.4 pp -45.87 -37.5 2.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.101 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.875 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.488 ' N ' HD12 ' A' ' 19' ' ' ILE . 30.3 m-85 -56.42 -21.95 28.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.967 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.91 44.25 1.95 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.176 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -154.39 141.94 19.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.834 0.349 . . . . 0.0 111.191 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.81 168.94 18.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.818 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.725 ' O ' HD23 ' A' ' 15' ' ' LEU . . . 170.51 -147.3 10.48 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.529 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -159.96 -176.65 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.4 -157.91 23.46 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.46 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -86.6 8.24 23.04 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.77 -36.41 15.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.806 0.336 . . . . 0.0 111.238 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.47 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 30.1 m-85 -127.87 1.14 6.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.673 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 t -125.33 -29.0 3.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.659 0.266 . . . . 0.0 111.296 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -56.3 176.75 0.87 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.773 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.16 154.06 42.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.341 . . . . 0.0 111.114 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 58.12 22.08 48.33 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.39 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -160.1 32.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.786 0.327 . . . . 0.0 110.709 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 44.5 t -141.26 118.21 11.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.098 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -87.56 -37.7 16.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.771 179.759 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.9 t -150.3 157.63 43.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.712 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 67.54 46.68 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.615 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.813 -179.974 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.1 p . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.888 0.375 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.407 ' HB2' ' CG ' ' A' ' 10' ' ' PRO . 20.4 p -85.28 -31.78 22.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.868 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.65 -50.87 70.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -179.841 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.36 -23.69 63.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.296 -179.773 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 25.95 9.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.267 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.448 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.16 164.71 26.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.711 179.916 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 90.5 Cg_endo -86.19 21.86 21.42 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.693 -1.378 . . . . 0.0 113.087 0.43 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.32 61.75 59.2 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.349 . . . . 0.0 110.829 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.407 ' CG ' ' HB2' ' A' ' 3' ' ' CYS . 85.5 Cg_endo -86.32 -47.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.752 2.301 . . . . 0.0 112.813 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.8 m -110.45 -178.59 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.889 0.376 . . . . 0.0 111.029 -179.734 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -63.9 -177.31 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.866 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 134.37 36.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.105 -179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.83 -26.02 17.12 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -101.12 136.78 40.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.839 0.352 . . . . 0.0 110.956 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 30.3 m -104.57 161.81 13.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.851 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.9 t -97.79 106.34 18.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 p -67.1 139.9 57.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.83 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.4 pt -47.16 -33.77 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.797 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.84 -17.87 57.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.075 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.1 42.7 2.55 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.09 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -138.34 176.3 8.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 111.152 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -122.08 137.42 54.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.424 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -168.44 -158.87 12.97 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.548 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.6 p -142.31 -168.02 2.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.036 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.78 -169.88 19.76 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.511 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.409 ' HA ' ' CA ' ' A' ' 31' ' ' GLY . . . -76.2 -4.86 44.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.561 0.219 . . . . 0.0 111.582 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.93 -37.8 38.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.774 0.321 . . . . 0.0 111.24 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.424 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 66.7 m-85 -112.91 -28.06 7.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.385 -179.783 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.0 m -104.41 -23.1 13.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.409 ' CA ' ' HA ' ' A' ' 27' ' ' ALA . . . -57.51 155.33 19.04 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.617 -179.872 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.56 145.86 37.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.804 0.335 . . . . 0.0 111.137 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.41 26.75 69.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.504 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -159.91 30.58 0.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.755 0.312 . . . . 0.0 110.921 -179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.26 125.71 11.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.991 -179.864 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.98 -58.42 3.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.854 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.415 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -131.67 168.45 17.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.877 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 62.94 46.81 4.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.808 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.981 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.873 0 N-CA-C 112.281 0.475 . . . . 1.9399999999999999 112.281 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.4 p -148.51 40.21 0.92 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 1.6299999999999999 110.866 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -67.99 -50.75 53.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.02 110.973 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -29.84 59.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.92000000000000004 111.227 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -26.61 64.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 1.3300000000000001 111.034 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -102.79 26.67 7.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 3.4500000000000002 111.079 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.402 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.7 m -83.92 162.17 53.18 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.417 . . . . 1.1599999999999999 110.794 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 83.7 Cg_endo -81.79 0.87 48.11 Favored 'Cis proline' 0 C--N 1.346 0.413 0 C-N-CA 123.383 -1.507 . . . . 0.94999999999999996 112.857 0.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.99 70.0 3.71 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 120.773 0.32 . . . . 3.6699999999999999 111.009 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.79 -44.23 0.38 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.616 2.211 . . . . 0.68000000000000005 112.407 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 97.0 m -113.1 -178.25 3.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 1.3200000000000001 110.973 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.9 -172.81 2.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 2.0099999999999998 110.86 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.87 140.22 36.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.60999999999999999 111.06 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.85 -28.18 12.88 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.792 -0.718 . . . . 0.56999999999999995 112.448 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -106.48 158.59 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.825 0.345 . . . . 0.81000000000000005 110.82 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.3 m -128.03 150.6 49.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.5 110.929 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -87.38 126.39 34.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 1.03 110.862 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.3 t -92.46 137.32 32.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 1.28 110.865 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.482 HG22 ' HD3' ' A' ' 36' ' ' ARG . 1.4 pt -47.42 -31.34 2.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 0.70999999999999996 111.568 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -58.13 -21.85 48.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 2.0899999999999999 110.978 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 22' ' ' TYR . . . 104.92 39.18 2.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.722 -0.751 . . . . 0.58999999999999997 112.369 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 21' ' ' GLY . 74.8 m-85 -159.41 143.33 14.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.872 0.368 . . . . 1.5700000000000001 111.05 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.9 m -78.11 179.84 6.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.81000000000000005 110.814 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 160.57 -145.6 11.33 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.676 -0.773 . . . . 0.48999999999999999 112.57 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.91 -170.5 3.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.841 0.353 . . . . 1.4399999999999999 110.958 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.61 -160.52 28.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.48999999999999999 112.554 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.63 -28.76 28.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 0.55000000000000004 111.202 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.23 -35.04 72.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.48999999999999999 111.167 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 97.7 m-85 -112.77 -33.15 6.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.228 -0.442 . . . . 1.3300000000000001 111.066 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -115.21 44.47 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 1.24 110.909 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -103.34 162.48 15.9 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.713 -0.755 . . . . 1.0800000000000001 112.526 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.5 103.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.81 0.338 . . . . 1.8400000000000001 111.122 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.59 -23.19 32.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.694 -0.765 . . . . 1.0600000000000001 112.619 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -103.58 27.15 7.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.731 0.301 . . . . 1.25 110.968 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.6 p -137.41 124.27 21.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.357 -0.383 . . . . 1.1399999999999999 110.962 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.482 ' HD3' HG22 ' A' ' 19' ' ' ILE . 1.4 tpp180 -79.87 -37.84 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 2.1699999999999999 110.872 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 m -146.52 167.69 23.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.93000000000000005 110.942 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 61.84 46.11 7.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.8700000000000001 110.738 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.5 m -100.33 -31.65 11.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.991 -0.549 . . . . 1.29 110.882 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -82.49 -32.62 28.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.132 -0.486 . . . . 5.5300000000000002 110.905 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.376 -1.236 . . . . 3.0600000000000001 112.502 179.987 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 p -148.44 46.07 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 10' ' ' PRO . 23.9 p -69.88 -21.53 63.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.2 -31.67 65.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.839 0.352 . . . . 0.0 111.305 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.4 t -67.69 -19.4 65.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.455 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -112.34 31.57 6.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 111.283 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 m -69.01 162.22 66.72 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -91.63 8.77 62.54 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.845 -1.314 . . . . 0.0 112.909 0.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 -135.01 66.91 69.23 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.0 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 93.5 Cg_endo -83.36 -42.87 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.733 2.289 . . . . 0.0 112.483 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.75 179.22 7.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.952 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.33 -171.6 3.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.801 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.11 134.04 35.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.047 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.68 -26.07 23.67 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.474 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -112.14 140.08 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.83 0.348 . . . . 0.0 110.892 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 38' ' ' GLN . 18.0 m -108.85 166.82 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.768 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 3.8 m -102.55 124.45 48.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.985 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.1 t -83.97 143.49 29.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.576 HG22 ' HB2' ' A' ' 36' ' ' ARG . 2.3 pp -47.8 -27.67 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.061 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -71.79 -5.91 37.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.541 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.86 6.35 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -133.73 179.37 6.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.855 0.36 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.71 148.83 51.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.792 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.87 -137.06 2.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.616 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.9 t -155.34 -169.0 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.984 0.421 . . . . 0.0 110.975 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.83 -171.97 25.47 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.509 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.62 -9.88 59.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.559 0.219 . . . . 0.0 111.523 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.95 -37.0 56.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.8 0.333 . . . . 0.0 111.207 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -110.39 -27.4 9.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.112 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.3 m -111.37 29.92 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.989 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -108.01 159.27 14.46 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.517 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.15 119.98 16.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.123 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.2 -28.19 11.44 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -107.5 -27.91 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.787 0.327 . . . . 0.0 110.973 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 45.5 t -85.58 105.9 16.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.576 ' HB2' HG22 ' A' ' 19' ' ' ILE . 7.6 ttp180 -79.99 -47.8 14.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.264 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.23 160.95 33.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 111.268 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.417 ' HB3' ' HA ' ' A' ' 16' ' ' CYS . 1.8 tm0? 62.31 46.17 6.18 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.821 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 m -103.03 -31.69 10.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.855 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -98.41 -32.06 11.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.978 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.413 -1.215 . . . . 0.0 112.544 -179.982 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.918 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.77 53.47 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.806 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.8 p -84.13 2.68 38.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.505 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.24 -30.35 68.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.786 0.327 . . . . 0.0 111.145 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 p -68.61 -22.05 64.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.317 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.15 29.93 6.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.798 0.332 . . . . 0.0 110.995 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.438 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.24 164.27 53.1 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.823 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 6.5 Cg_endo -87.52 4.06 69.21 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 124.064 -1.223 . . . . 0.0 112.859 0.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -127.64 69.54 75.88 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 120.924 0.392 . . . . 0.0 110.907 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -81.03 -43.2 0.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.622 2.215 . . . . 0.0 112.396 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 51.5 m -85.74 162.14 18.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -63.93 -173.59 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.13 134.3 36.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.075 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 105.83 -26.17 21.81 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.498 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.417 HD23 ' O ' ' A' ' 24' ' ' GLY . 2.6 mp -105.17 169.32 8.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.33 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 m -146.21 150.25 35.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -87.26 126.16 34.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.29 142.64 30.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.066 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.441 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.3 pt -47.17 -32.01 2.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.828 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -61.75 -18.41 59.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.083 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.81 40.21 2.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.064 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -139.38 -176.58 4.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 110.94 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.4 t -132.5 155.59 48.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.417 ' O ' HD23 ' A' ' 15' ' ' LEU . . . 173.91 -132.28 2.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.547 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.07 -172.01 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.857 0.36 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.41 -160.21 46.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.46 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.91 -29.55 29.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.784 0.326 . . . . 0.0 111.099 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.05 79.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.227 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -108.18 -29.73 8.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.007 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 2.0 t -120.38 39.53 3.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.098 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.62 171.79 53.01 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.352 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.46 65.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.897 0.38 . . . . 0.0 111.038 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.14 28.54 7.21 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.345 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -148.78 28.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.789 0.328 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.1 p -124.6 123.14 39.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.2 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.441 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.5 tpp180 -79.93 -41.8 25.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.48 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 m -151.61 161.23 43.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.45 46.43 5.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.021 0.439 . . . . 0.0 110.617 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 59.9 m -79.33 -30.74 42.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.913 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.64 -31.32 52.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.875 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.516 -179.963 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.406 ' HG1' ' HB2' ' A' ' 5' ' ' SER . 2.9 t -151.58 43.57 0.75 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.92 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.1 p -65.54 -25.45 67.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.038 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.72 -35.32 74.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.406 ' HB2' ' HG1' ' A' ' 2' ' ' THR . 19.5 m -64.59 -15.9 61.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.734 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -123.34 37.94 4.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.669 0.271 . . . . 0.0 111.374 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.9 m -74.17 160.05 82.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.767 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -89.65 6.83 68.34 Favored 'Cis proline' 0 N--CA 1.46 -0.482 0 C-N-CA 123.576 -1.426 . . . . 0.0 112.753 0.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 77.52 62.24 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.51 -30.29 2.55 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.603 2.202 . . . . 0.0 112.616 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.1 m -115.08 175.28 5.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.053 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -63.45 -170.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.923 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 133.6 36.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.76 -26.35 18.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.44 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.452 ' O ' ' NE2' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -88.93 165.11 14.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.801 0.334 . . . . 0.0 110.835 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.6 m -143.07 149.66 38.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.11 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.1 t -90.37 109.04 20.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.527 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.4 p -74.44 140.03 44.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.108 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.51 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.0 pp -46.98 -34.36 2.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.87 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -59.64 -19.4 48.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.067 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.21 41.02 2.68 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.044 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -137.27 173.98 11.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.9 0.381 . . . . 0.0 111.02 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.25 129.03 49.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.841 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -162.62 -145.17 4.25 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.483 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -142.79 -172.98 3.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.81 -162.43 11.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.464 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.73 -26.2 54.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.77 0.319 . . . . 0.0 111.26 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.53 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.342 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.0 m-85 -127.43 5.57 6.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -150.65 30.52 0.66 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.878 0.37 . . . . 0.0 110.924 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.07 -171.6 47.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.544 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -76.83 -32.23 57.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.67 16.63 12.39 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.667 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -141.73 33.83 1.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.786 0.327 . . . . 0.0 110.75 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.9 t -136.22 104.33 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.198 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.51 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.5 OUTLIER -79.92 -52.58 7.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.719 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.48 164.2 21.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.452 ' NE2' ' O ' ' A' ' 15' ' ' LEU . 1.7 tt0 61.37 45.86 8.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.3 m -106.63 -30.36 9.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.925 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -109.88 29.58 7.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.902 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.386 -1.23 . . . . 0.0 112.498 179.965 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.885 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.0 p -112.15 32.26 5.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.882 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.56 -48.52 74.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.11 -37.6 85.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.125 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 m -68.78 -28.73 67.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.063 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.61 28.06 7.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.018 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.412 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 3.4 m -90.0 162.63 34.8 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.851 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.412 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 80.6 Cg_endo -89.21 17.31 41.46 Favored 'Cis proline' 0 C--N 1.347 0.466 0 C-N-CA 123.66 -1.392 . . . . 0.0 112.893 0.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -129.32 63.4 67.39 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.922 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -82.84 -43.01 0.09 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.693 2.262 . . . . 0.0 112.357 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.2 m -94.62 163.68 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -74.05 -173.33 1.58 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.08 133.37 36.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.08 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 -25.68 25.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.54 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -109.49 137.46 47.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.355 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 74.6 m -107.73 151.09 26.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.1 119.6 33.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.046 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.434 ' HB2' ' CD2' ' A' ' 29' ' ' TYR . 0.4 OUTLIER -77.98 146.18 35.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.702 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.461 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.9 pt -44.58 -30.18 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.033 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.405 ' N ' HG13 ' A' ' 19' ' ' ILE . 2.8 m-85 -59.91 -18.98 49.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.957 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.21 41.96 3.35 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.044 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -150.56 144.35 25.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.928 0.394 . . . . 0.0 111.404 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 m -79.67 158.2 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.917 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.421 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . -178.89 -139.36 3.53 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.563 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.01 -170.93 3.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 0.0 110.97 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.34 -166.71 10.85 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.542 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.18 -27.34 47.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.795 0.331 . . . . 0.0 111.184 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.14 73.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.128 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.434 ' CD2' ' HB2' ' A' ' 18' ' ' SER . 10.8 m-85 -109.54 -27.4 9.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.004 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.4 t -122.18 48.29 1.76 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -122.54 159.22 17.19 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.498 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.15 116.48 3.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.791 0.329 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.19 -16.69 45.4 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.662 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.416 ' HA ' HG12 ' A' ' 19' ' ' ILE . 50.8 m-20 -132.11 44.12 2.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.881 0.372 . . . . 0.0 110.843 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.1 t -127.2 105.8 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.107 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.461 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -79.79 -57.53 3.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.792 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.5 m -143.88 169.5 17.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.876 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 61.86 46.16 7.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -24.6 34.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.993 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -30.79 64.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.968 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.373 -1.237 . . . . 0.0 112.484 179.954 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.899 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p -153.25 35.88 0.47 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.821 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.403 ' HB2' ' CB ' ' A' ' 10' ' ' PRO . 7.5 p -62.41 -30.91 71.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.04 -39.19 74.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.297 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 t -70.32 -21.04 62.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.215 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -97.24 23.07 7.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.148 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.5 m -70.52 161.09 78.92 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.832 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -84.71 1.37 62.02 Favored 'Cis proline' 0 C--N 1.347 0.469 0 C-N-CA 123.475 -1.469 . . . . 0.0 112.862 0.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -126.5 76.75 73.66 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.768 0.318 . . . . 0.0 110.967 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.403 ' CB ' ' HB2' ' A' ' 3' ' ' CYS . 16.0 Cg_exo -67.98 -66.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.746 2.298 . . . . 0.0 112.337 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.1 m -95.95 179.77 4.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.039 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.39 -170.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.952 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.96 137.03 36.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.005 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.14 -28.23 12.46 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.446 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.04 169.81 9.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.8 0.333 . . . . 0.0 110.853 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 m -141.97 150.35 41.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 43.1 t -98.22 108.22 20.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.25 137.52 46.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.478 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.0 pt -46.11 -33.19 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.903 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.54 -20.31 45.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.019 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 101.18 41.91 2.5 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.142 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 6.5 m-85 -148.01 146.49 28.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 111.171 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -91.65 152.77 20.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.773 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.27 -144.62 5.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.577 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.0 t -157.45 -169.87 3.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.834 0.349 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.35 -167.56 18.17 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.511 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.62 -12.25 60.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.686 0.279 . . . . 0.0 111.525 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.75 -34.31 66.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.791 0.329 . . . . 0.0 111.194 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -116.74 -21.02 9.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.515 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 -12.16 14.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.669 -0.242 . . . . 0.0 111.477 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.7 162.85 44.57 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.497 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.58 149.86 49.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.834 0.349 . . . . 0.0 111.121 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.29 24.15 58.62 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.527 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -160.06 39.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.9 p -159.97 120.29 2.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.078 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.478 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 9.5 ttm180 -79.82 -56.92 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.3 m -123.85 165.81 16.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.42 46.97 4.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.862 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -131.2 -44.98 1.02 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.921 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.18 -29.58 19.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.911 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.415 -1.214 . . . . 0.0 112.456 179.969 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.889 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.3 p -138.97 40.88 2.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.911 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.2 t -74.66 -43.69 54.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.518 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -63.2 -40.32 97.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.131 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.1 m -70.16 -23.85 63.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.275 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -98.07 23.66 7.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.115 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.3 m -78.89 161.52 68.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.636 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -87.46 4.34 69.15 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.706 -1.372 . . . . 0.0 112.987 0.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.32 73.67 67.47 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 0.0 111.085 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HG3' ' HB2' ' A' ' 17' ' ' CYS . 72.7 Cg_endo -76.85 -42.97 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.565 2.177 . . . . 0.0 112.243 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.9 m -114.03 176.9 4.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.971 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.48 -174.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.969 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 146.76 31.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.93 -25.18 28.27 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.47 154.23 20.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.816 0.341 . . . . 0.0 110.905 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.9 m -120.03 150.56 40.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.963 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.414 ' HB2' ' HG3' ' A' ' 10' ' ' PRO . 18.4 t -84.56 113.7 21.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.998 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.44 137.64 37.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.759 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 29.5 pt -45.72 -37.0 2.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.824 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -56.54 -22.43 33.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.965 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 103.93 41.04 2.19 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.184 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.408 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 20.7 m-85 -153.67 143.03 21.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.817 0.342 . . . . 0.0 111.149 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.52 169.44 18.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.435 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 168.07 -150.42 16.4 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.417 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -152.44 -169.49 3.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.935 0.398 . . . . 0.0 111.004 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.19 -160.2 35.76 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.5 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.78 -30.6 26.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.859 0.361 . . . . 0.0 111.16 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -35.62 72.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.435 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 53.2 m-85 -110.63 -28.5 8.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.042 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 47.55 2.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 110.952 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -104.02 165.27 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.436 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.28 92.59 1.04 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 111.102 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.0 16.03 14.76 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.651 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -137.05 12.8 3.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.607 0.241 . . . . 0.0 111.232 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.3 p -127.43 137.98 52.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 110.864 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.518 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -79.97 -53.52 6.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.945 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 p -149.55 169.03 21.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.52 47.73 2.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.792 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.6 m -102.46 26.34 7.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.953 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -82.67 -33.01 27.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.869 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 CA-C-O 118.397 -1.224 . . . . 0.0 112.477 179.997 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.887 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t -148.79 34.31 0.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.854 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 t -64.88 -47.64 77.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.974 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.41 86.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.128 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -22.75 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.093 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 28.32 7.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.806 0.336 . . . . 0.0 111.059 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.404 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.77 162.88 58.6 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.778 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.404 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 81.2 Cg_endo -89.62 14.12 51.11 Favored 'Cis proline' 0 C--N 1.347 0.497 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.819 0.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.28 63.42 67.39 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.808 0.337 . . . . 0.0 110.972 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -84.12 -44.06 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.726 2.284 . . . . 0.0 112.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.455 ' HB3' HD12 ' A' ' 15' ' ' LEU . 56.3 m -82.08 154.6 25.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.898 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.4 -170.85 0.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.832 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.84 120.29 24.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.99 -12.27 17.39 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.765 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.455 HD12 ' HB3' ' A' ' 11' ' ' CYS . 0.0 OUTLIER -134.35 139.57 45.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -92.94 -178.1 4.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.0 t -113.51 123.22 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.789 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.2 p -83.93 145.8 28.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.402 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.536 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.8 pt -46.66 -27.18 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.105 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.085 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.401 ' N ' HG13 ' A' ' 19' ' ' ILE . 20.6 m-85 -75.0 0.65 15.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.607 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.96 37.59 18.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.017 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -129.6 178.41 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 111.053 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.403 ' O ' ' CE1' ' A' ' 29' ' ' TYR . 71.1 m -126.79 157.86 38.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.85 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.408 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 169.84 -147.89 11.31 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.623 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.16 -168.01 2.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.967 0.413 . . . . 0.0 111.046 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.35 -165.79 26.82 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.521 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 -27.48 54.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.789 0.328 . . . . 0.0 111.112 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.51 75.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.408 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 88.0 m-85 -107.58 -30.19 8.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.109 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.4 m -115.09 38.92 3.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.987 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.49 -166.99 40.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.439 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.38 -35.7 14.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.893 0.378 . . . . 0.0 111.155 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.67 23.46 29.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.494 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -153.98 43.96 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 7.6 t -125.54 102.79 7.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.041 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.536 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 2.9 tpt180 -79.84 -46.25 17.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.825 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.3 m -150.1 168.38 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 62.48 46.15 5.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.813 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.7 m -97.57 -30.8 12.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.927 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.86 -31.09 28.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.893 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.381 -1.233 . . . . 0.0 112.453 -179.967 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.887 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.8 p -131.03 43.11 3.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.807 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 t -86.35 -49.07 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.968 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.91 71.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.191 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.6 -27.43 66.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.065 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.95 28.99 7.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.972 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.416 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.8 m -89.97 163.03 33.71 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.741 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 76.9 Cg_endo -87.81 4.84 69.33 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.655 -1.394 . . . . 0.0 112.907 0.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -120.84 66.9 14.28 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.362 . . . . 0.0 111.113 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -77.58 -43.33 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.58 2.187 . . . . 0.0 112.481 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.0 m -105.87 171.7 7.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.06 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.9 -170.02 2.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.935 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.92 134.04 36.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.011 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.07 -26.79 9.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.367 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -114.63 147.38 39.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.869 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -119.95 146.35 45.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.858 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.5 t -85.13 119.18 25.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.744 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.8 t -77.76 145.27 36.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.4 pt -46.79 -26.01 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.104 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.45 9.74 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.532 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.8 44.76 37.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.621 -0.8 . . . . 0.0 112.278 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -145.52 122.17 11.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.809 0.338 . . . . 0.0 111.205 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -73.3 170.04 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.775 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.426 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 158.66 -152.7 23.83 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.596 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.5 p -145.11 -168.21 2.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.391 . . . . 0.0 111.06 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.33 -169.94 42.87 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.39 -16.35 58.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.682 0.277 . . . . 0.0 111.435 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.03 -34.02 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.759 0.314 . . . . 0.0 111.309 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.426 ' CD2' ' HA3' ' A' ' 24' ' ' GLY . 74.1 m-85 -107.96 -33.66 7.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.204 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.7 m -108.71 28.2 8.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.044 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -79.73 -174.84 47.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.557 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.35 -33.01 16.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.35 . . . . 0.0 111.066 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.55 19.66 44.34 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.602 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -152.79 48.45 0.73 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.362 . . . . 0.0 110.726 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.3 t -126.35 103.32 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -79.89 -54.79 5.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.7 m -138.56 170.31 16.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.943 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.39 47.37 3.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.72 25.35 7.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.0 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -147.71 30.7 0.89 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.847 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.399 -1.223 . . . . 0.0 112.524 -179.993 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.863 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p -141.39 45.28 1.74 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.804 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 19.4 p -79.67 -21.03 45.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.186 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.624 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -53.87 -26.38 24.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.728 0.299 . . . . 0.0 111.389 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.6 p -74.24 -14.48 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.523 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -96.02 9.62 40.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.573 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.27 144.16 83.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.428 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -95.78 26.85 19.38 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.315 -1.119 . . . . 0.0 112.968 0.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.474 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 11.8 mtm-85 -130.82 53.4 11.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.662 0.268 . . . . 0.0 111.355 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.482 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 95.6 Cg_endo -84.9 -43.59 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.573 2.182 . . . . 0.0 112.714 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 t -100.0 170.75 8.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.107 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -81.8 -174.63 5.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.02 129.37 34.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.096 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.7 -22.41 37.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.616 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.6 166.52 11.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 110.981 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -132.98 155.04 49.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.765 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.63 103.69 16.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.844 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.49 140.56 56.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.001 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.407 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.1 pp -45.87 -39.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.806 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.407 ' N ' HD12 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -56.61 -22.41 33.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.988 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.89 45.93 1.44 Allowed Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.119 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -152.77 133.03 13.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.158 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.25 162.18 28.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.843 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 168.52 -159.44 32.6 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.53 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -144.81 -177.37 5.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.796 0.332 . . . . 0.0 110.846 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.62 -169.87 8.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.3 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.51 -15.88 61.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.61 0.243 . . . . 0.0 111.371 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.57 78.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.717 0.294 . . . . 0.0 111.414 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -133.37 17.0 4.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.4 t -160.08 30.2 0.17 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.05 176.93 32.26 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.502 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.12 109.28 2.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.823 0.344 . . . . 0.0 111.075 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.23 -23.06 37.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.617 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -107.94 29.93 6.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.813 0.34 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.7 t -129.04 118.22 22.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.624 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 0.9 OUTLIER -81.02 -64.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.966 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.406 ' CB ' ' HG3' ' A' ' 10' ' ' PRO . 80.6 m -127.4 163.84 23.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.872 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.4 46.68 4.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.82 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 m -100.75 23.54 10.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.12 -33.46 7.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.878 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.509 -179.984 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PCA . . . . . 0.465 ' O ' HG23 ' A' ' 2' ' ' THR . . . . . . . . 0 N--CA 1.441 -0.902 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 1' ' ' PCA . 24.4 p -158.8 45.11 0.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.792 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -73.64 -40.89 63.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.33 -32.63 74.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.145 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 -26.44 65.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.037 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 mtp180 -106.22 28.98 7.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.958 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.444 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.3 m -85.03 164.7 40.53 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.444 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 79.0 Cg_endo -86.67 2.84 68.1 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.65 -1.396 . . . . 0.0 112.915 0.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -124.34 68.96 50.49 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.98 -27.28 2.55 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.617 2.211 . . . . 0.0 112.579 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -109.2 171.72 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.072 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -71.58 -174.22 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 133.46 36.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.97 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.82 -26.82 11.08 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.336 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.8 170.29 7.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.749 0.309 . . . . 0.0 110.803 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.2 m -141.62 161.33 38.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.933 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.7 t -93.72 132.74 37.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.088 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -93.68 138.4 31.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.891 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.443 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.2 pp -45.69 -38.12 2.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.819 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.443 ' N ' HD12 ' A' ' 19' ' ' ILE . 99.1 m-85 -57.0 -22.16 36.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.074 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.05 41.41 2.11 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.072 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -154.27 141.01 19.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.854 0.359 . . . . 0.0 111.034 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -74.18 175.57 7.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.899 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.418 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.2 -146.65 11.68 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.427 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 m -155.49 -170.89 3.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.886 0.374 . . . . 0.0 110.967 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.16 -160.91 42.16 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.441 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.58 -29.93 25.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.737 0.303 . . . . 0.0 111.087 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.15 -36.31 79.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.208 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.418 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 79.2 m-85 -108.12 -29.77 8.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.008 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 5.0 t -126.33 48.83 2.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.96 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.64 -146.34 19.69 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.411 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -119.98 76.16 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 111.038 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.05 -27.94 3.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.401 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -98.08 21.74 10.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.675 0.274 . . . . 0.0 111.042 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 19.6 p -120.22 135.31 55.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.35 . . . . 0.0 110.913 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.409 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.2 OUTLIER -79.97 -39.94 29.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.866 179.924 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.8 m -148.75 166.12 29.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.28 46.75 2.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.8 m -102.74 -28.41 12.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.963 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.52 24.73 7.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.922 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.403 -1.22 . . . . 0.0 112.489 180.0 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.916 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.9 p -148.63 44.11 1.01 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.783 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.7 t -78.51 -32.73 48.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.903 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.21 86.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.058 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -70.26 -22.71 62.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.02 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.1 mtp180 -79.92 -21.47 43.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.134 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.2 m -52.68 160.24 1.47 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.951 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -90.35 18.75 38.3 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.897 0.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.18 66.32 45.28 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.748 0.309 . . . . 0.0 111.231 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -71.85 -42.73 1.51 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.771 2.314 . . . . 0.0 112.261 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.8 m -122.15 172.17 8.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.103 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 140.03 36.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.045 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.28 -27.95 14.17 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.432 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.78 171.77 8.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.813 0.34 . . . . 0.0 110.916 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.6 m -146.89 159.37 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.836 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.2 t -98.33 127.28 44.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 t -88.91 139.34 30.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 21.1 pt -46.01 -36.72 2.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.823 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -19.66 29.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.083 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.77 46.53 1.92 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.112 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -154.13 142.99 21.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.915 0.388 . . . . 0.0 111.283 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.4 ' O ' ' CD2' ' A' ' 29' ' ' TYR . 0.5 OUTLIER -81.59 170.66 15.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.797 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.437 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 159.81 -150.27 20.45 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.578 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.1 t -148.42 -170.06 3.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.912 0.386 . . . . 0.0 110.994 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.39 -157.14 37.42 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.516 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.48 -26.76 29.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 0.0 111.194 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.26 75.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.17 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.437 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 34.2 m-85 -116.56 -17.96 10.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.447 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -129.81 32.25 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.761 0.315 . . . . 0.0 110.958 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.15 177.52 39.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.506 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.67 132.12 42.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.86 0.362 . . . . 0.0 111.14 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.19 24.56 58.88 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.468 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -143.28 23.48 1.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 111.134 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.2 p -131.36 125.73 33.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.015 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -43.95 21.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.974 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -136.34 167.66 20.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.961 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 61.64 45.82 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.793 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.1 m -104.2 -31.87 9.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.875 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -143.69 30.93 1.32 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.902 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.385 -1.231 . . . . 0.0 112.5 179.966 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.912 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.2 p 63.14 49.92 3.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.618 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.8 m -49.38 -54.73 15.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.231 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -52.8 -41.71 64.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.241 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.8 t -67.26 -27.39 67.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.032 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.3 mtm105 -118.41 30.07 7.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.04 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.429 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.6 m -84.98 164.2 42.75 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.726 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 72.6 Cg_endo -89.83 19.98 33.94 Favored 'Cis proline' 0 C--N 1.347 0.495 0 C-N-CA 123.791 -1.337 . . . . 0.0 112.936 0.32 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.414 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 31.8 mtp180 -137.59 64.82 45.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.701 0.286 . . . . 0.0 111.199 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 17.3 Cg_exo -67.1 -51.66 0.75 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.585 2.19 . . . . 0.0 112.104 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.03 -177.06 4.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -72.43 -174.99 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 139.96 35.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.113 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.72 -25.25 28.14 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.448 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -108.36 144.06 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.831 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.3 m -108.58 139.78 42.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.744 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.88 106.37 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 35' ' ' CYS . 18.8 p -66.24 140.82 58.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.034 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 34' ' ' ASN . 2.3 pp -48.12 -33.71 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.655 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -56.71 -22.87 38.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.032 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.27 41.44 1.78 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.38 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -158.81 134.51 8.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.838 0.351 . . . . 0.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.67 152.12 20.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 29' ' ' TYR . . . -174.43 -136.37 2.23 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.484 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -147.92 -169.9 3.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.915 0.388 . . . . 0.0 110.919 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 -161.38 45.59 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.499 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.25 -25.87 36.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.771 0.32 . . . . 0.0 111.219 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.31 80.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.239 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.436 ' CD2' ' N ' ' A' ' 24' ' ' GLY . 54.3 m-85 -108.91 -37.97 5.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.073 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 77.8 m -114.04 47.97 1.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.949 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.67 -155.75 30.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.478 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.7 115.32 29.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.856 0.36 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.06 10.7 86.03 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.764 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.445 ' O ' HG23 ' A' ' 19' ' ' ILE . 39.7 m-20 -113.33 -29.92 7.08 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.783 0.325 . . . . 0.0 110.971 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 18' ' ' SER . 28.1 p -83.78 129.1 34.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.106 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.443 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.7 ttp180 -79.72 -54.47 5.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.813 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 17.3 m -127.9 163.01 25.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 62.45 46.72 5.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.778 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.7 m -92.79 -28.77 16.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.987 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.86 27.29 7.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.919 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.394 -1.225 . . . . 0.0 112.461 179.985 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.863 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.2 p -103.64 27.72 7.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -65.45 -47.83 74.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.983 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.665 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -58.11 -21.95 48.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.335 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.56 -22.06 63.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.293 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -103.56 25.71 9.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.778 0.323 . . . . 0.0 111.312 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.76 142.46 91.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.341 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -97.53 22.11 25.58 Favored 'Cis proline' 0 N--CA 1.457 -0.623 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.066 0.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 65.28 69.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 0.0 111.405 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.24 -26.8 3.97 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.599 2.199 . . . . 0.0 112.435 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 m -137.01 -179.82 5.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.0 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.85 -171.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.979 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.01 135.36 36.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.014 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.03 -27.31 17.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.62 122.18 46.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.859 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.2 m -97.82 159.56 14.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.901 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 48.8 t -94.7 118.45 31.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.7 t -80.04 139.6 36.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.045 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.409 HG22 ' HG3' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -45.6 -32.04 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.651 -179.9 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -22.37 34.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.71 37.21 3.05 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.22 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -156.08 144.4 19.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 68.2 m -74.58 175.07 8.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.898 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.416 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 166.36 -148.51 13.64 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.474 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 78.8 p -150.57 -170.52 3.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.75 -164.09 17.64 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.53 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.87 -29.19 32.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.796 0.332 . . . . 0.0 111.173 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.6 72.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.18 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.416 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.9 m-85 -109.82 -28.53 8.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 t -127.7 50.44 2.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.884 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -125.53 170.47 17.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.531 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.15 124.87 21.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 111.092 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.66 2.49 85.5 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -137.68 37.41 2.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.2 p -143.66 110.89 5.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.665 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 4.2 ttt180 -80.22 -62.93 1.53 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 80.0 m -118.95 157.58 27.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.9 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 62.24 46.42 6.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.794 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.5 t -114.6 -36.35 4.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.964 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.9 tpt85 -78.0 -32.43 51.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.935 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.365 -1.242 . . . . 0.0 112.477 179.993 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.91 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p 58.18 38.11 26.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.755 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 6.4 p -62.23 -26.11 68.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.254 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.58 -31.11 66.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.0 p -70.67 -12.66 61.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.704 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -110.04 25.12 12.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.683 0.278 . . . . 0.0 111.425 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.439 ' SG ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -64.11 148.52 95.34 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.323 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 71.2 Cg_endo -98.31 20.35 26.1 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.432 -1.07 . . . . 0.0 113.081 0.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -137.06 67.33 55.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.749 0.309 . . . . 0.0 111.033 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.46 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 85.6 Cg_endo -83.59 -44.48 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.596 2.197 . . . . 0.0 112.695 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 m -109.04 166.46 10.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -67.83 -171.22 0.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.796 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 128.64 33.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.095 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 113.49 -22.52 15.05 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.611 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -109.7 169.18 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.84 0.352 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.2 m -140.24 178.0 7.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.931 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.42 ' HB3' ' HB2' ' A' ' 37' ' ' CYS . 39.7 t -112.9 118.45 34.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.813 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.6 p -87.63 137.5 32.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.113 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.656 HG22 ' HD3' ' A' ' 36' ' ' ARG . 1.9 pp -46.88 -32.15 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.69 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -56.73 -21.57 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.967 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.17 42.44 2.23 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.162 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -149.09 175.6 11.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.166 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.2 t -116.84 157.17 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.427 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 173.91 -149.13 10.58 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.485 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.8 m -147.04 -170.02 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.897 0.38 . . . . 0.0 111.0 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.08 -160.04 22.26 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.95 -24.34 38.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.76 0.314 . . . . 0.0 111.237 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.69 -37.14 75.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.159 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.427 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 83.7 m-85 -114.98 -34.34 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.022 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.66 42.96 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.924 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -113.97 -167.0 16.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.509 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.61 107.48 19.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.844 0.354 . . . . 0.0 111.063 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.06 -17.06 24.9 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.736 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -130.09 42.61 3.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.896 0.379 . . . . 0.0 110.904 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 t -146.54 107.72 4.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.656 ' HD3' HG22 ' A' ' 19' ' ' ILE . 0.5 OUTLIER -87.55 -50.68 6.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.051 179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.42 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 26.9 m -123.42 157.24 33.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 62.51 46.82 5.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.909 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 34.1 m -101.13 -31.57 10.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.912 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ptt-85 -79.2 -30.96 43.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.852 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.386 -1.23 . . . . 0.0 112.494 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.871 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.7 p -130.11 42.97 3.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.749 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.62 -55.27 28.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.075 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.52 -36.09 63.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.325 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -68.86 -25.5 64.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.05 28.47 8.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.146 -179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 m -90.09 161.78 36.97 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.756 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -89.72 22.79 25.96 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.871 0.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.1 60.29 50.21 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.969 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -85.82 -46.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.762 2.308 . . . . 0.0 112.626 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.9 m -83.38 175.11 10.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.959 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -79.21 -175.68 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.89 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 131.78 35.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.082 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.35 -24.87 29.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.486 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -107.13 164.58 12.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -123.4 -170.44 2.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 37.8 t -123.77 131.0 53.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.034 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.96 143.12 26.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.918 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.642 HG23 ' O ' ' A' ' 34' ' ' ASN . 1.5 pt -47.53 -28.53 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.816 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.19 -20.62 42.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.917 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 41.23 2.53 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.222 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -151.72 -175.92 5.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 47.8 m -122.48 164.18 18.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.744 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 176.14 -145.41 7.54 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.564 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.12 -170.42 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.868 0.366 . . . . 0.0 110.958 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.81 -173.9 25.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.511 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.43 -15.31 61.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.661 0.267 . . . . 0.0 111.45 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.4 -35.29 63.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.79 0.329 . . . . 0.0 111.393 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 85.5 m-85 -107.41 -31.29 8.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.171 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.4 m -108.67 26.45 10.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.044 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -64.13 -149.18 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.359 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.83 -36.34 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.372 . . . . 0.0 111.201 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.3 -20.61 5.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.744 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' ' 19' ' ' ILE . 81.0 m-20 -79.88 -30.52 40.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.784 0.326 . . . . 0.0 111.017 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 27.6 p -82.93 127.93 33.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.504 ' HB2' HG22 ' A' ' 19' ' ' ILE . 22.0 ttp180 -92.3 -37.38 12.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.044 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.49 153.18 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.893 0.377 . . . . 0.0 111.013 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 63.0 47.35 4.32 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.827 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.3 m -91.99 -35.22 14.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -91.1 -31.22 16.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.913 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.399 -1.223 . . . . 0.0 112.496 -179.987 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.916 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p 58.14 34.97 24.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.969 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.1 p -55.84 -25.57 42.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.288 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.738 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -61.85 -37.4 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.893 0.378 . . . . 0.0 111.131 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.93 -25.58 62.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.212 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -103.1 21.4 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.394 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.439 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.18 164.36 28.01 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.615 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 97.6 Cg_endo -85.23 25.87 11.7 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 123.745 -1.356 . . . . 0.0 113.278 0.513 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.03 60.49 45.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.523 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 88.8 Cg_endo -85.69 -45.07 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.828 2.352 . . . . 0.0 112.821 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.9 m -119.56 176.58 5.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.011 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -169.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.756 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.91 128.4 33.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.061 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -23.26 11.54 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.399 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -110.78 138.95 46.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.826 0.346 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.5 m -118.21 169.09 9.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.893 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 49.0 t -97.01 117.06 30.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.954 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 p -76.9 139.31 40.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.055 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.458 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.3 pp -46.25 -39.11 3.49 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.088 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.838 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.458 ' N ' HD12 ' A' ' 19' ' ' ILE . 1.9 m-85 -57.82 -21.13 40.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.977 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.62 46.12 1.56 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.166 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -153.52 137.5 16.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 111.181 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -77.03 158.56 30.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.778 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 172.78 -165.76 38.23 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.569 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.4 m -129.32 -170.25 2.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.83 -174.1 4.44 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.98 -24.8 58.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.79 0.329 . . . . 0.0 111.218 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.6 77.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.231 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -119.55 0.37 11.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.53 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.7 t -152.65 35.89 0.5 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.814 0.34 . . . . 0.0 110.842 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.71 171.68 16.19 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.7 116.38 4.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.792 0.329 . . . . 0.0 111.14 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.03 -24.42 18.86 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.614 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -131.01 42.96 3.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.854 0.359 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 53.6 t -128.12 106.81 9.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.096 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.738 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 14.3 ttt180 -79.92 -58.9 2.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.6 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.37 170.07 17.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.609 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.74 45.33 7.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.74 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -20.94 47.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.091 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -29.04 62.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.025 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.089 0 CA-C-O 118.365 -1.242 . . . . 0.0 112.421 -179.968 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.944 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 p -135.41 45.27 2.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.808 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.7 t -73.14 -56.86 4.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.079 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.81 -35.91 64.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.287 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.93 -26.61 64.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mtm-85 -107.94 23.94 13.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.282 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -90.18 160.39 40.18 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.8 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -87.69 28.71 11.3 Favored 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 123.631 -1.404 . . . . 0.0 112.925 0.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.59 57.3 27.64 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 0.0 110.823 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -82.22 -31.52 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.638 2.225 . . . . 0.0 112.464 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.13 175.83 5.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.125 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -96.87 -170.91 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.81 123.18 27.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.919 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.07 -20.08 24.31 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.359 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -114.41 179.61 3.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.82 0.343 . . . . 0.0 110.783 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 76.4 m -150.85 147.84 27.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.002 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.07 126.05 34.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.1 t -86.97 141.34 28.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.036 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.427 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.3 pt -47.23 -28.47 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.11 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -65.11 -14.28 60.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.2 40.24 4.31 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.998 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -152.48 139.91 19.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.167 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.4 m -75.06 172.94 11.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.42 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.28 -147.08 12.17 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.469 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 t -156.71 -170.85 3.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.909 0.385 . . . . 0.0 110.941 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.27 -160.38 46.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.5 -28.19 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 111.201 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.49 -35.26 79.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.234 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.42 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 89.8 m-85 -109.9 -29.95 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.8 t -124.06 53.24 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -90.78 -120.98 2.35 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.456 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.64 -43.67 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.923 0.392 . . . . 0.0 111.144 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.07 -12.05 18.95 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.718 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -103.81 27.07 7.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.711 0.291 . . . . 0.0 111.035 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 10.7 p -122.95 124.26 42.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.995 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -80.57 -56.46 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.867 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -136.8 162.42 33.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.931 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.22 46.19 6.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.614 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.5 t -104.28 -30.92 9.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.857 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.92 26.75 10.23 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.551 179.944 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.8 p -144.32 39.9 1.32 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.1 t -60.46 -31.63 70.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.936 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.21 -32.39 72.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.055 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 t -69.94 -22.3 63.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.167 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 75.6 mtm-85 -101.53 25.68 8.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -83.31 159.72 61.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.798 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -87.43 12.1 54.39 Favored 'Cis proline' 0 C--N 1.346 0.437 0 C-N-CA 123.472 -1.47 . . . . 0.0 112.802 0.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -126.45 65.61 59.97 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.751 0.31 . . . . 0.0 111.005 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -82.3 -43.0 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.685 2.256 . . . . 0.0 112.425 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.5 m -93.66 162.67 13.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.047 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.74 -169.84 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.762 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.89 128.92 34.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.036 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.97 -23.14 28.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.477 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.499 ' N ' HD12 ' A' ' 15' ' ' LEU . 1.9 mp -117.36 146.37 43.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.79 0.329 . . . . 0.0 110.902 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 m -111.88 171.84 7.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.34 124.07 40.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.428 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . 22.1 p -87.75 138.62 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.947 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.682 HG22 ' HB2' ' A' ' 36' ' ' ARG . 2.6 pt -46.99 -29.88 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.077 -179.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.401 ' N ' HG13 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -65.53 -14.11 60.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.214 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.9 41.07 3.91 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.101 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -155.97 146.24 21.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.839 0.352 . . . . 0.0 111.153 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.1 m -82.56 167.11 18.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.909 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.426 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 173.36 -152.37 15.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.577 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.8 p -149.21 -169.33 3.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.924 0.393 . . . . 0.0 111.045 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.66 -166.68 51.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.521 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.77 57.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.656 0.265 . . . . 0.0 111.455 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.16 -33.3 44.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.289 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.428 ' CD2' ' HB3' ' A' ' 18' ' ' SER . 48.1 m-85 -110.7 -30.51 7.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.1 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 67.0 m -118.86 37.67 4.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.821 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -88.65 -142.43 8.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.06 37.95 4.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 0.0 111.075 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -170.97 -41.21 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.419 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.515 ' O ' HG23 ' A' ' 19' ' ' ILE . 81.0 m-20 -80.28 -23.59 40.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.737 0.303 . . . . 0.0 111.08 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 22.6 p -79.98 106.25 11.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.032 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.682 ' HB2' HG22 ' A' ' 19' ' ' ILE . 27.5 ttp180 -80.25 -44.9 18.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.107 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.56 154.96 41.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.94 0.4 . . . . 0.0 111.293 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.44 ' O ' ' NE2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 63.72 46.92 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.112 179.808 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -128.45 -41.98 1.51 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -84.89 -25.94 27.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.871 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.382 -1.232 . . . . 0.0 112.519 179.991 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.892 0 N-CA-C 112.324 0.491 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.9 p -131.57 43.56 3.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.788 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -95.54 -34.51 12.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.925 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.86 -40.25 96.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -26.34 66.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.413 ' HB3' ' HA ' ' A' ' 10' ' ' PRO . 2.7 mtt180 -79.87 -23.49 41.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.161 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -44.75 139.21 3.77 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -97.12 44.21 2.91 Favored 'Cis proline' 0 C--N 1.348 0.547 0 C-N-CA 124.388 -1.088 . . . . 0.0 113.21 0.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.457 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 2.3 mmt180 -143.42 51.99 1.89 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.638 0.256 . . . . 0.0 111.423 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.457 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 88.0 Cg_endo -82.78 -32.7 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.536 2.157 . . . . 0.0 112.565 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -141.36 171.09 14.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.63 -171.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.889 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.17 138.86 32.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.18 -28.22 12.43 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.471 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.725 HD23 ' O ' ' A' ' 24' ' ' GLY . 0.8 OUTLIER -97.98 161.71 13.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.807 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.4 m -133.13 163.69 28.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.0 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -100.96 128.51 46.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.711 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.5 p -90.05 143.08 27.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.227 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.488 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.4 pp -45.87 -37.5 2.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.101 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.875 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.488 ' N ' HD12 ' A' ' 19' ' ' ILE . 30.3 m-85 -56.42 -21.95 28.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.967 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.91 44.25 1.95 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.176 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -154.39 141.94 19.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.834 0.349 . . . . 0.0 111.191 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.81 168.94 18.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.818 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.725 ' O ' HD23 ' A' ' 15' ' ' LEU . . . 170.51 -147.3 10.48 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.529 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -159.96 -176.65 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.4 -157.91 23.46 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.46 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -86.6 8.24 23.04 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.77 -36.41 15.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.806 0.336 . . . . 0.0 111.238 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.47 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 30.1 m-85 -127.87 1.14 6.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.673 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 t -125.33 -29.0 3.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.659 0.266 . . . . 0.0 111.296 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -56.3 176.75 0.87 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.773 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.16 154.06 42.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.341 . . . . 0.0 111.114 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 58.12 22.08 48.33 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.39 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -160.1 32.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.786 0.327 . . . . 0.0 110.709 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 44.5 t -141.26 118.21 11.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.098 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -87.56 -37.7 16.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.771 179.759 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.9 t -150.3 157.63 43.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.712 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 67.54 46.68 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.615 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.2 m -100.97 -32.51 10.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.813 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 -162.16 30.5 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.851 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.4 -1.222 . . . . 0.0 112.474 -179.969 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.9 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.1 p -140.44 48.4 1.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.729 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.407 ' HB2' ' CG ' ' A' ' 10' ' ' PRO . 20.4 p -85.28 -31.78 22.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.868 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.65 -50.87 70.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -179.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.36 -23.69 63.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.296 -179.773 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 25.95 9.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.267 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.448 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.16 164.71 26.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.711 179.916 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 90.5 Cg_endo -86.19 21.86 21.42 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.693 -1.378 . . . . 0.0 113.087 0.43 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.32 61.75 59.2 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.349 . . . . 0.0 110.829 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.407 ' CG ' ' HB2' ' A' ' 3' ' ' CYS . 85.5 Cg_endo -86.32 -47.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.752 2.301 . . . . 0.0 112.813 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.8 m -110.45 -178.59 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.889 0.376 . . . . 0.0 111.029 -179.734 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -63.9 -177.31 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.866 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 134.37 36.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.105 -179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.83 -26.02 17.12 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -101.12 136.78 40.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.839 0.352 . . . . 0.0 110.956 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 30.3 m -104.57 161.81 13.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.851 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.9 t -97.79 106.34 18.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 p -67.1 139.9 57.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.83 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.4 pt -47.16 -33.77 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.797 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.84 -17.87 57.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.075 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.1 42.7 2.55 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.09 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -138.34 176.3 8.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 111.152 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -122.08 137.42 54.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.424 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -168.44 -158.87 12.97 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.548 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.6 p -142.31 -168.02 2.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.036 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.78 -169.88 19.76 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.511 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.409 ' HA ' ' CA ' ' A' ' 31' ' ' GLY . . . -76.2 -4.86 44.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.561 0.219 . . . . 0.0 111.582 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.93 -37.8 38.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.774 0.321 . . . . 0.0 111.24 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.424 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 66.7 m-85 -112.91 -28.06 7.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.385 -179.783 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.0 m -104.41 -23.1 13.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.409 ' CA ' ' HA ' ' A' ' 27' ' ' ALA . . . -57.51 155.33 19.04 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.617 -179.872 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.56 145.86 37.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.804 0.335 . . . . 0.0 111.137 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.41 26.75 69.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.504 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -159.91 30.58 0.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.755 0.312 . . . . 0.0 110.921 -179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.26 125.71 11.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.991 -179.864 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.98 -58.42 3.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.854 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.415 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -131.67 168.45 17.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.877 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 62.94 46.81 4.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.808 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.34 -38.54 3.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.981 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -102.84 -31.67 10.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.431 -1.205 . . . . 0.0 112.529 -179.99 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.4 p . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.863 0.363 . . . . 1.6299999999999999 110.866 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -67.99 -50.75 53.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.02 110.973 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -29.84 59.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.92000000000000004 111.227 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -26.61 64.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 1.3300000000000001 111.034 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -102.79 26.67 7.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 3.4500000000000002 111.079 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.402 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.7 m -83.92 162.17 53.18 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.417 . . . . 1.1599999999999999 110.794 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 83.7 Cg_endo -81.79 0.87 48.11 Favored 'Cis proline' 0 C--N 1.346 0.413 0 C-N-CA 123.383 -1.507 . . . . 0.94999999999999996 112.857 0.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.99 70.0 3.71 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 120.773 0.32 . . . . 3.6699999999999999 111.009 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.79 -44.23 0.38 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.616 2.211 . . . . 0.68000000000000005 112.407 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 97.0 m -113.1 -178.25 3.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 1.3200000000000001 110.973 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.9 -172.81 2.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 2.0099999999999998 110.86 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.87 140.22 36.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.60999999999999999 111.06 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.85 -28.18 12.88 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.792 -0.718 . . . . 0.56999999999999995 112.448 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -106.48 158.59 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.825 0.345 . . . . 0.81000000000000005 110.82 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.3 m -128.03 150.6 49.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.5 110.929 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -87.38 126.39 34.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 1.03 110.862 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.3 t -92.46 137.32 32.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 1.28 110.865 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.482 HG22 ' HD3' ' A' ' 36' ' ' ARG . 1.4 pt -47.42 -31.34 2.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 0.70999999999999996 111.568 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -58.13 -21.85 48.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 2.0899999999999999 110.978 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 22' ' ' TYR . . . 104.92 39.18 2.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.722 -0.751 . . . . 0.58999999999999997 112.369 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 21' ' ' GLY . 74.8 m-85 -159.41 143.33 14.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.872 0.368 . . . . 1.5700000000000001 111.05 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.9 m -78.11 179.84 6.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.81000000000000005 110.814 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 160.57 -145.6 11.33 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.676 -0.773 . . . . 0.48999999999999999 112.57 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.91 -170.5 3.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.841 0.353 . . . . 1.4399999999999999 110.958 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.61 -160.52 28.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.48999999999999999 112.554 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.63 -28.76 28.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 0.55000000000000004 111.202 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.23 -35.04 72.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.48999999999999999 111.167 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 97.7 m-85 -112.77 -33.15 6.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.228 -0.442 . . . . 1.3300000000000001 111.066 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -115.21 44.47 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 1.24 110.909 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -103.34 162.48 15.9 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.713 -0.755 . . . . 1.0800000000000001 112.526 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.5 103.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.81 0.338 . . . . 1.8400000000000001 111.122 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.59 -23.19 32.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.694 -0.765 . . . . 1.0600000000000001 112.619 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -103.58 27.15 7.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.731 0.301 . . . . 1.25 110.968 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.6 p -137.41 124.27 21.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.357 -0.383 . . . . 1.1399999999999999 110.962 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.482 ' HD3' HG22 ' A' ' 19' ' ' ILE . 1.4 tpp180 -79.87 -37.84 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 2.1699999999999999 110.872 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 m -146.52 167.69 23.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.93000000000000005 110.942 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 61.84 46.11 7.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.8700000000000001 110.738 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.5 m . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.991 -0.549 . . . . 1.29 110.882 179.957 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.944 0.402 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 10' ' ' PRO . 23.9 p -69.88 -21.53 63.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.2 -31.67 65.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.839 0.352 . . . . 0.0 111.305 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.4 t -67.69 -19.4 65.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.455 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -112.34 31.57 6.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 111.283 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 m -69.01 162.22 66.72 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -91.63 8.77 62.54 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.845 -1.314 . . . . 0.0 112.909 0.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 -135.01 66.91 69.23 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.0 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 93.5 Cg_endo -83.36 -42.87 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.733 2.289 . . . . 0.0 112.483 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.75 179.22 7.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.952 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.33 -171.6 3.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.801 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.11 134.04 35.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.047 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.68 -26.07 23.67 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.474 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -112.14 140.08 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.83 0.348 . . . . 0.0 110.892 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 38' ' ' GLN . 18.0 m -108.85 166.82 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.768 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 3.8 m -102.55 124.45 48.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.985 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.1 t -83.97 143.49 29.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.576 HG22 ' HB2' ' A' ' 36' ' ' ARG . 2.3 pp -47.8 -27.67 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.061 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -71.79 -5.91 37.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.541 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.86 6.35 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -133.73 179.37 6.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.855 0.36 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.71 148.83 51.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.792 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.87 -137.06 2.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.616 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.9 t -155.34 -169.0 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.984 0.421 . . . . 0.0 110.975 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.83 -171.97 25.47 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.509 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.62 -9.88 59.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.559 0.219 . . . . 0.0 111.523 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.95 -37.0 56.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.8 0.333 . . . . 0.0 111.207 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -110.39 -27.4 9.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.112 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.3 m -111.37 29.92 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.989 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -108.01 159.27 14.46 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.517 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.15 119.98 16.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.123 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.2 -28.19 11.44 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -107.5 -27.91 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.787 0.327 . . . . 0.0 110.973 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 45.5 t -85.58 105.9 16.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.576 ' HB2' HG22 ' A' ' 19' ' ' ILE . 7.6 ttp180 -79.99 -47.8 14.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.264 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.23 160.95 33.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 111.268 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.417 ' HB3' ' HA ' ' A' ' 16' ' ' CYS . 1.8 tm0? 62.31 46.17 6.18 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.821 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 m . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.855 179.958 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.871 0.367 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.8 p -84.13 2.68 38.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.505 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.24 -30.35 68.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.786 0.327 . . . . 0.0 111.145 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 p -68.61 -22.05 64.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.317 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.15 29.93 6.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.798 0.332 . . . . 0.0 110.995 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.438 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.24 164.27 53.1 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.823 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 6.5 Cg_endo -87.52 4.06 69.21 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 124.064 -1.223 . . . . 0.0 112.859 0.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -127.64 69.54 75.88 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 120.924 0.392 . . . . 0.0 110.907 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -81.03 -43.2 0.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.622 2.215 . . . . 0.0 112.396 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 51.5 m -85.74 162.14 18.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -63.93 -173.59 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.13 134.3 36.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.075 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 105.83 -26.17 21.81 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.498 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.417 HD23 ' O ' ' A' ' 24' ' ' GLY . 2.6 mp -105.17 169.32 8.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.33 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 m -146.21 150.25 35.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -87.26 126.16 34.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.29 142.64 30.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.066 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.441 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.3 pt -47.17 -32.01 2.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.828 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -61.75 -18.41 59.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.083 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.81 40.21 2.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.064 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -139.38 -176.58 4.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 110.94 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.4 t -132.5 155.59 48.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.417 ' O ' HD23 ' A' ' 15' ' ' LEU . . . 173.91 -132.28 2.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.547 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.07 -172.01 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.857 0.36 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.41 -160.21 46.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.46 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.91 -29.55 29.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.784 0.326 . . . . 0.0 111.099 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.05 79.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.227 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -108.18 -29.73 8.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.007 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 2.0 t -120.38 39.53 3.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.098 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.62 171.79 53.01 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.352 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.46 65.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.897 0.38 . . . . 0.0 111.038 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.14 28.54 7.21 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.345 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -148.78 28.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.789 0.328 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.1 p -124.6 123.14 39.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.2 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.441 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.5 tpp180 -79.93 -41.8 25.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.48 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 m -151.61 161.23 43.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.45 46.43 5.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.021 0.439 . . . . 0.0 110.617 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 59.9 m . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.913 179.894 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.406 ' HG1' ' HB2' ' A' ' 5' ' ' SER . 2.9 t . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.878 0.37 . . . . 0.0 110.92 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.1 p -65.54 -25.45 67.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.038 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.72 -35.32 74.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.406 ' HB2' ' HG1' ' A' ' 2' ' ' THR . 19.5 m -64.59 -15.9 61.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.734 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -123.34 37.94 4.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.669 0.271 . . . . 0.0 111.374 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.9 m -74.17 160.05 82.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.767 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -89.65 6.83 68.34 Favored 'Cis proline' 0 N--CA 1.46 -0.482 0 C-N-CA 123.576 -1.426 . . . . 0.0 112.753 0.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 77.52 62.24 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.51 -30.29 2.55 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.603 2.202 . . . . 0.0 112.616 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.1 m -115.08 175.28 5.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.053 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -63.45 -170.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.923 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 133.6 36.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.76 -26.35 18.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.44 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.93 165.11 14.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.801 0.334 . . . . 0.0 110.835 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.6 m -143.07 149.66 38.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.11 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.1 t -90.37 109.04 20.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.527 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.4 p -74.44 140.03 44.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.108 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.51 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.0 pp -46.98 -34.36 2.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.87 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -59.64 -19.4 48.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.067 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.21 41.02 2.68 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.044 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -137.27 173.98 11.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.9 0.381 . . . . 0.0 111.02 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.25 129.03 49.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.841 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -162.62 -145.17 4.25 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.483 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -142.79 -172.98 3.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.81 -162.43 11.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.464 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.73 -26.2 54.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.77 0.319 . . . . 0.0 111.26 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.53 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.342 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.0 m-85 -127.43 5.57 6.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -150.65 30.52 0.66 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.878 0.37 . . . . 0.0 110.924 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.07 -171.6 47.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.544 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -76.83 -32.23 57.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.67 16.63 12.39 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.667 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -141.73 33.83 1.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.786 0.327 . . . . 0.0 110.75 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.9 t -136.22 104.33 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.198 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.51 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.5 OUTLIER -79.92 -52.58 7.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.719 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.48 164.2 21.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 61.37 45.86 8.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.3 m . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.925 -179.992 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.792 0.33 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.56 -48.52 74.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.11 -37.6 85.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.125 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 m -68.78 -28.73 67.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.063 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.61 28.06 7.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.018 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.412 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 3.4 m -90.0 162.63 34.8 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.851 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.412 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 80.6 Cg_endo -89.21 17.31 41.46 Favored 'Cis proline' 0 C--N 1.347 0.466 0 C-N-CA 123.66 -1.392 . . . . 0.0 112.893 0.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -129.32 63.4 67.39 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.922 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -82.84 -43.01 0.09 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.693 2.262 . . . . 0.0 112.357 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.2 m -94.62 163.68 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -74.05 -173.33 1.58 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.08 133.37 36.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.08 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 -25.68 25.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.54 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -109.49 137.46 47.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.355 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 74.6 m -107.73 151.09 26.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.1 119.6 33.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.046 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.434 ' HB2' ' CD2' ' A' ' 29' ' ' TYR . 0.4 OUTLIER -77.98 146.18 35.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.702 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.461 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.9 pt -44.58 -30.18 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.033 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.405 ' N ' HG13 ' A' ' 19' ' ' ILE . 2.8 m-85 -59.91 -18.98 49.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.957 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.21 41.96 3.35 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.044 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -150.56 144.35 25.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.928 0.394 . . . . 0.0 111.404 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 m -79.67 158.2 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.917 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.421 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . -178.89 -139.36 3.53 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.563 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.01 -170.93 3.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 0.0 110.97 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.34 -166.71 10.85 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.542 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.18 -27.34 47.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.795 0.331 . . . . 0.0 111.184 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.14 73.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.128 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.434 ' CD2' ' HB2' ' A' ' 18' ' ' SER . 10.8 m-85 -109.54 -27.4 9.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.004 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.4 t -122.18 48.29 1.76 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -122.54 159.22 17.19 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.498 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.15 116.48 3.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.791 0.329 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.19 -16.69 45.4 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.662 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.416 ' HA ' HG12 ' A' ' 19' ' ' ILE . 50.8 m-20 -132.11 44.12 2.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.881 0.372 . . . . 0.0 110.843 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.1 t -127.2 105.8 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.107 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.461 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -79.79 -57.53 3.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.792 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.5 m -143.88 169.5 17.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.876 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 61.86 46.16 7.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.993 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.837 0.351 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.403 ' HB2' ' CB ' ' A' ' 10' ' ' PRO . 7.5 p -62.41 -30.91 71.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.04 -39.19 74.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.297 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 t -70.32 -21.04 62.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.215 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -97.24 23.07 7.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.148 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.5 m -70.52 161.09 78.92 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.832 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -84.71 1.37 62.02 Favored 'Cis proline' 0 C--N 1.347 0.469 0 C-N-CA 123.475 -1.469 . . . . 0.0 112.862 0.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -126.5 76.75 73.66 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.768 0.318 . . . . 0.0 110.967 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.403 ' CB ' ' HB2' ' A' ' 3' ' ' CYS . 16.0 Cg_exo -67.98 -66.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.746 2.298 . . . . 0.0 112.337 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.1 m -95.95 179.77 4.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.039 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.39 -170.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.952 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.96 137.03 36.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.005 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.14 -28.23 12.46 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.446 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.04 169.81 9.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.8 0.333 . . . . 0.0 110.853 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 m -141.97 150.35 41.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 43.1 t -98.22 108.22 20.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.25 137.52 46.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.478 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.0 pt -46.11 -33.19 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.903 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.54 -20.31 45.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.019 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 101.18 41.91 2.5 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.142 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 6.5 m-85 -148.01 146.49 28.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 111.171 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -91.65 152.77 20.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.773 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.27 -144.62 5.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.577 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.0 t -157.45 -169.87 3.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.834 0.349 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.35 -167.56 18.17 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.511 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.62 -12.25 60.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.686 0.279 . . . . 0.0 111.525 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.75 -34.31 66.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.791 0.329 . . . . 0.0 111.194 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -116.74 -21.02 9.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.515 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 -12.16 14.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.669 -0.242 . . . . 0.0 111.477 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.7 162.85 44.57 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.497 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.58 149.86 49.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.834 0.349 . . . . 0.0 111.121 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.29 24.15 58.62 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.527 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -160.06 39.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.9 p -159.97 120.29 2.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.078 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.478 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 9.5 ttm180 -79.82 -56.92 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.3 m -123.85 165.81 16.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.42 46.97 4.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.862 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.921 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.3 p . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.823 0.344 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.2 t -74.66 -43.69 54.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.518 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -63.2 -40.32 97.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.131 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.1 m -70.16 -23.85 63.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.275 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -98.07 23.66 7.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.115 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.3 m -78.89 161.52 68.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.636 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -87.46 4.34 69.15 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.706 -1.372 . . . . 0.0 112.987 0.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.32 73.67 67.47 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 0.0 111.085 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HG3' ' HB2' ' A' ' 17' ' ' CYS . 72.7 Cg_endo -76.85 -42.97 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.565 2.177 . . . . 0.0 112.243 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.9 m -114.03 176.9 4.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.971 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.48 -174.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.969 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 146.76 31.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.93 -25.18 28.27 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.47 154.23 20.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.816 0.341 . . . . 0.0 110.905 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.9 m -120.03 150.56 40.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.963 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.414 ' HB2' ' HG3' ' A' ' 10' ' ' PRO . 18.4 t -84.56 113.7 21.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.998 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.44 137.64 37.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.759 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 29.5 pt -45.72 -37.0 2.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.824 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -56.54 -22.43 33.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.965 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 103.93 41.04 2.19 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.184 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.408 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 20.7 m-85 -153.67 143.03 21.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.817 0.342 . . . . 0.0 111.149 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.52 169.44 18.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.435 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 168.07 -150.42 16.4 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.417 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -152.44 -169.49 3.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.935 0.398 . . . . 0.0 111.004 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.19 -160.2 35.76 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.5 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.78 -30.6 26.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.859 0.361 . . . . 0.0 111.16 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -35.62 72.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.435 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 53.2 m-85 -110.63 -28.5 8.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.042 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 47.55 2.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 110.952 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -104.02 165.27 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.436 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.28 92.59 1.04 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 111.102 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.0 16.03 14.76 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.651 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -137.05 12.8 3.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.607 0.241 . . . . 0.0 111.232 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.3 p -127.43 137.98 52.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 110.864 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.518 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -79.97 -53.52 6.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.945 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 p -149.55 169.03 21.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.52 47.73 2.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.792 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.6 m . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.953 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.917 0.389 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 t -64.88 -47.64 77.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.974 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.41 86.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.128 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -22.75 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.093 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 28.32 7.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.806 0.336 . . . . 0.0 111.059 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.404 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.77 162.88 58.6 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.778 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.404 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 81.2 Cg_endo -89.62 14.12 51.11 Favored 'Cis proline' 0 C--N 1.347 0.497 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.819 0.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.28 63.42 67.39 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.808 0.337 . . . . 0.0 110.972 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -84.12 -44.06 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.726 2.284 . . . . 0.0 112.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.455 ' HB3' HD12 ' A' ' 15' ' ' LEU . 56.3 m -82.08 154.6 25.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.898 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.4 -170.85 0.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.832 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.84 120.29 24.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.99 -12.27 17.39 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.765 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.455 HD12 ' HB3' ' A' ' 11' ' ' CYS . 0.0 OUTLIER -134.35 139.57 45.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -92.94 -178.1 4.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.0 t -113.51 123.22 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.789 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.2 p -83.93 145.8 28.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.402 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.536 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.8 pt -46.66 -27.18 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.105 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.085 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.401 ' N ' HG13 ' A' ' 19' ' ' ILE . 20.6 m-85 -75.0 0.65 15.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.607 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.96 37.59 18.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.017 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -129.6 178.41 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 111.053 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.403 ' O ' ' CE1' ' A' ' 29' ' ' TYR . 71.1 m -126.79 157.86 38.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.85 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.408 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 169.84 -147.89 11.31 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.623 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.16 -168.01 2.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.967 0.413 . . . . 0.0 111.046 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.35 -165.79 26.82 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.521 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 -27.48 54.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.789 0.328 . . . . 0.0 111.112 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.51 75.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.408 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 88.0 m-85 -107.58 -30.19 8.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.109 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.4 m -115.09 38.92 3.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.987 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.49 -166.99 40.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.439 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.38 -35.7 14.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.893 0.378 . . . . 0.0 111.155 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.67 23.46 29.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.494 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -153.98 43.96 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 7.6 t -125.54 102.79 7.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.041 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.536 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 2.9 tpt180 -79.84 -46.25 17.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.825 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.3 m -150.1 168.38 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 62.48 46.15 5.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.813 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.7 m . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.927 179.972 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.8 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.909 0.385 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 t -86.35 -49.07 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.968 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.91 71.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.191 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.6 -27.43 66.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.065 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.95 28.99 7.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.972 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.416 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.8 m -89.97 163.03 33.71 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.741 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 76.9 Cg_endo -87.81 4.84 69.33 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.655 -1.394 . . . . 0.0 112.907 0.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -120.84 66.9 14.28 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.362 . . . . 0.0 111.113 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -77.58 -43.33 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.58 2.187 . . . . 0.0 112.481 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.0 m -105.87 171.7 7.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.06 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.9 -170.02 2.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.935 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.92 134.04 36.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.011 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.07 -26.79 9.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.367 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -114.63 147.38 39.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.869 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -119.95 146.35 45.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.858 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.5 t -85.13 119.18 25.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.744 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.8 t -77.76 145.27 36.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.4 pt -46.79 -26.01 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.104 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.45 9.74 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.532 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.8 44.76 37.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.621 -0.8 . . . . 0.0 112.278 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -145.52 122.17 11.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.809 0.338 . . . . 0.0 111.205 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -73.3 170.04 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.775 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.426 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 158.66 -152.7 23.83 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.596 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.5 p -145.11 -168.21 2.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.391 . . . . 0.0 111.06 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.33 -169.94 42.87 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.39 -16.35 58.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.682 0.277 . . . . 0.0 111.435 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.03 -34.02 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.759 0.314 . . . . 0.0 111.309 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.426 ' CD2' ' HA3' ' A' ' 24' ' ' GLY . 74.1 m-85 -107.96 -33.66 7.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.204 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.7 m -108.71 28.2 8.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.044 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -79.73 -174.84 47.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.557 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.35 -33.01 16.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.35 . . . . 0.0 111.066 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.55 19.66 44.34 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.602 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -152.79 48.45 0.73 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.362 . . . . 0.0 110.726 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.3 t -126.35 103.32 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -79.89 -54.79 5.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.7 m -138.56 170.31 16.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.943 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.39 47.37 3.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.0 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.894 0.378 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 19.4 p -79.67 -21.03 45.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.186 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.624 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -53.87 -26.38 24.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.728 0.299 . . . . 0.0 111.389 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.6 p -74.24 -14.48 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.523 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -96.02 9.62 40.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.573 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.27 144.16 83.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.428 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -95.78 26.85 19.38 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.315 -1.119 . . . . 0.0 112.968 0.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.474 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 11.8 mtm-85 -130.82 53.4 11.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.662 0.268 . . . . 0.0 111.355 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.482 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 95.6 Cg_endo -84.9 -43.59 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.573 2.182 . . . . 0.0 112.714 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 t -100.0 170.75 8.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.107 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -81.8 -174.63 5.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.02 129.37 34.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.096 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.7 -22.41 37.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.616 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.6 166.52 11.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 110.981 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -132.98 155.04 49.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.765 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.63 103.69 16.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.844 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.49 140.56 56.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.001 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.407 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.1 pp -45.87 -39.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.806 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.407 ' N ' HD12 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -56.61 -22.41 33.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.988 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.89 45.93 1.44 Allowed Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.119 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -152.77 133.03 13.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.158 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.25 162.18 28.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.843 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 168.52 -159.44 32.6 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.53 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -144.81 -177.37 5.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.796 0.332 . . . . 0.0 110.846 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.62 -169.87 8.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.3 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.51 -15.88 61.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.61 0.243 . . . . 0.0 111.371 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.57 78.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.717 0.294 . . . . 0.0 111.414 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -133.37 17.0 4.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.4 t -160.08 30.2 0.17 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.05 176.93 32.26 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.502 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.12 109.28 2.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.823 0.344 . . . . 0.0 111.075 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.23 -23.06 37.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.617 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -107.94 29.93 6.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.813 0.34 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.7 t -129.04 118.22 22.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.624 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 0.9 OUTLIER -81.02 -64.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.966 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.406 ' CB ' ' HG3' ' A' ' 10' ' ' PRO . 80.6 m -127.4 163.84 23.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.872 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.4 46.68 4.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.82 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 m . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.938 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.954 0.407 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -73.64 -40.89 63.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.33 -32.63 74.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.145 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 -26.44 65.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.037 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 mtp180 -106.22 28.98 7.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.958 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.444 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.3 m -85.03 164.7 40.53 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.444 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 79.0 Cg_endo -86.67 2.84 68.1 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.65 -1.396 . . . . 0.0 112.915 0.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -124.34 68.96 50.49 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.98 -27.28 2.55 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.617 2.211 . . . . 0.0 112.579 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -109.2 171.72 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.072 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -71.58 -174.22 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 133.46 36.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.97 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.82 -26.82 11.08 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.336 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.8 170.29 7.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.749 0.309 . . . . 0.0 110.803 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.2 m -141.62 161.33 38.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.933 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.7 t -93.72 132.74 37.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.088 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -93.68 138.4 31.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.891 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.443 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.2 pp -45.69 -38.12 2.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.819 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.443 ' N ' HD12 ' A' ' 19' ' ' ILE . 99.1 m-85 -57.0 -22.16 36.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.074 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.05 41.41 2.11 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.072 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -154.27 141.01 19.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.854 0.359 . . . . 0.0 111.034 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -74.18 175.57 7.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.899 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.418 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.2 -146.65 11.68 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.427 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 m -155.49 -170.89 3.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.886 0.374 . . . . 0.0 110.967 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.16 -160.91 42.16 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.441 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.58 -29.93 25.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.737 0.303 . . . . 0.0 111.087 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.15 -36.31 79.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.208 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.418 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 79.2 m-85 -108.12 -29.77 8.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.008 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 5.0 t -126.33 48.83 2.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.96 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.64 -146.34 19.69 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.411 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -119.98 76.16 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 111.038 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.05 -27.94 3.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.401 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -98.08 21.74 10.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.675 0.274 . . . . 0.0 111.042 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 19.6 p -120.22 135.31 55.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.35 . . . . 0.0 110.913 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.409 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.2 OUTLIER -79.97 -39.94 29.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.866 179.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.8 m -148.75 166.12 29.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.28 46.75 2.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.8 m . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.963 179.862 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.9 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.922 0.391 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.7 t -78.51 -32.73 48.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.903 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.21 86.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.058 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -70.26 -22.71 62.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.02 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.1 mtp180 -79.92 -21.47 43.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.134 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.2 m -52.68 160.24 1.47 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.951 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -90.35 18.75 38.3 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.897 0.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.18 66.32 45.28 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.748 0.309 . . . . 0.0 111.231 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -71.85 -42.73 1.51 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.771 2.314 . . . . 0.0 112.261 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.8 m -122.15 172.17 8.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.103 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 140.03 36.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.045 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.28 -27.95 14.17 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.432 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.78 171.77 8.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.813 0.34 . . . . 0.0 110.916 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.6 m -146.89 159.37 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.836 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.2 t -98.33 127.28 44.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 t -88.91 139.34 30.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 21.1 pt -46.01 -36.72 2.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.823 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -19.66 29.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.083 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.77 46.53 1.92 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.112 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -154.13 142.99 21.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.915 0.388 . . . . 0.0 111.283 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.4 ' O ' ' CD2' ' A' ' 29' ' ' TYR . 0.5 OUTLIER -81.59 170.66 15.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.797 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.437 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 159.81 -150.27 20.45 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.578 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.1 t -148.42 -170.06 3.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.912 0.386 . . . . 0.0 110.994 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.39 -157.14 37.42 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.516 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.48 -26.76 29.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 0.0 111.194 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.26 75.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.17 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.437 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 34.2 m-85 -116.56 -17.96 10.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.447 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -129.81 32.25 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.761 0.315 . . . . 0.0 110.958 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.15 177.52 39.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.506 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.67 132.12 42.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.86 0.362 . . . . 0.0 111.14 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.19 24.56 58.88 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.468 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -143.28 23.48 1.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 111.134 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.2 p -131.36 125.73 33.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.015 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -43.95 21.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.974 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -136.34 167.66 20.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.961 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 61.64 45.82 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.793 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.1 m . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.875 179.917 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.2 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.007 0.432 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.8 m -49.38 -54.73 15.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.231 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -52.8 -41.71 64.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.241 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.8 t -67.26 -27.39 67.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.032 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.3 mtm105 -118.41 30.07 7.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.04 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.429 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.6 m -84.98 164.2 42.75 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.726 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 72.6 Cg_endo -89.83 19.98 33.94 Favored 'Cis proline' 0 C--N 1.347 0.495 0 C-N-CA 123.791 -1.337 . . . . 0.0 112.936 0.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.414 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 31.8 mtp180 -137.59 64.82 45.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.701 0.286 . . . . 0.0 111.199 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 17.3 Cg_exo -67.1 -51.66 0.75 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.585 2.19 . . . . 0.0 112.104 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.03 -177.06 4.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -72.43 -174.99 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 139.96 35.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.113 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.72 -25.25 28.14 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.448 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -108.36 144.06 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.831 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.3 m -108.58 139.78 42.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.744 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.88 106.37 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 35' ' ' CYS . 18.8 p -66.24 140.82 58.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.034 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 34' ' ' ASN . 2.3 pp -48.12 -33.71 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.655 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -56.71 -22.87 38.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.032 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.27 41.44 1.78 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.38 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -158.81 134.51 8.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.838 0.351 . . . . 0.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.67 152.12 20.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 29' ' ' TYR . . . -174.43 -136.37 2.23 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.484 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -147.92 -169.9 3.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.915 0.388 . . . . 0.0 110.919 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 -161.38 45.59 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.499 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.25 -25.87 36.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.771 0.32 . . . . 0.0 111.219 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.31 80.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.239 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.436 ' CD2' ' N ' ' A' ' 24' ' ' GLY . 54.3 m-85 -108.91 -37.97 5.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.073 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 77.8 m -114.04 47.97 1.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.949 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.67 -155.75 30.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.478 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.7 115.32 29.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.856 0.36 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.06 10.7 86.03 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.764 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.445 ' O ' HG23 ' A' ' 19' ' ' ILE . 39.7 m-20 -113.33 -29.92 7.08 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.783 0.325 . . . . 0.0 110.971 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 18' ' ' SER . 28.1 p -83.78 129.1 34.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.106 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.443 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.7 ttp180 -79.72 -54.47 5.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.813 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 17.3 m -127.9 163.01 25.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 62.45 46.72 5.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.778 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.987 -179.989 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.846 0.355 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -65.45 -47.83 74.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.983 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.665 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -58.11 -21.95 48.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.335 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.56 -22.06 63.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.293 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -103.56 25.71 9.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.778 0.323 . . . . 0.0 111.312 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.76 142.46 91.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.341 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -97.53 22.11 25.58 Favored 'Cis proline' 0 N--CA 1.457 -0.623 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.066 0.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 65.28 69.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 0.0 111.405 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.24 -26.8 3.97 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.599 2.199 . . . . 0.0 112.435 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 m -137.01 -179.82 5.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.0 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.85 -171.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.979 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.01 135.36 36.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.014 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.03 -27.31 17.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.62 122.18 46.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.859 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.2 m -97.82 159.56 14.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.901 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 48.8 t -94.7 118.45 31.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.7 t -80.04 139.6 36.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.045 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.409 HG22 ' HG3' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -45.6 -32.04 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.651 -179.9 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -22.37 34.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.71 37.21 3.05 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.22 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -156.08 144.4 19.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 68.2 m -74.58 175.07 8.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.898 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.416 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 166.36 -148.51 13.64 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.474 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 78.8 p -150.57 -170.52 3.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.75 -164.09 17.64 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.53 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.87 -29.19 32.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.796 0.332 . . . . 0.0 111.173 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.6 72.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.18 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.416 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.9 m-85 -109.82 -28.53 8.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 t -127.7 50.44 2.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.884 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -125.53 170.47 17.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.531 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.15 124.87 21.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 111.092 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.66 2.49 85.5 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -137.68 37.41 2.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.2 p -143.66 110.89 5.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.665 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 4.2 ttt180 -80.22 -62.93 1.53 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 80.0 m -118.95 157.58 27.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.9 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 62.24 46.42 6.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.794 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.5 t . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.964 179.951 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.878 0.37 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 6.4 p -62.23 -26.11 68.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.254 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.58 -31.11 66.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.0 p -70.67 -12.66 61.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.704 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -110.04 25.12 12.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.683 0.278 . . . . 0.0 111.425 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.439 ' SG ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -64.11 148.52 95.34 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.323 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 71.2 Cg_endo -98.31 20.35 26.1 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.432 -1.07 . . . . 0.0 113.081 0.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -137.06 67.33 55.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.749 0.309 . . . . 0.0 111.033 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.46 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 85.6 Cg_endo -83.59 -44.48 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.596 2.197 . . . . 0.0 112.695 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 m -109.04 166.46 10.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -67.83 -171.22 0.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.796 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 128.64 33.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.095 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 113.49 -22.52 15.05 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.611 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -109.7 169.18 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.84 0.352 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.2 m -140.24 178.0 7.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.931 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.42 ' HB3' ' HB2' ' A' ' 37' ' ' CYS . 39.7 t -112.9 118.45 34.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.813 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.6 p -87.63 137.5 32.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.113 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.656 HG22 ' HD3' ' A' ' 36' ' ' ARG . 1.9 pp -46.88 -32.15 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.69 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -56.73 -21.57 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.967 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.17 42.44 2.23 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.162 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -149.09 175.6 11.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.166 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.2 t -116.84 157.17 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.427 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 173.91 -149.13 10.58 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.485 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.8 m -147.04 -170.02 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.897 0.38 . . . . 0.0 111.0 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.08 -160.04 22.26 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.95 -24.34 38.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.76 0.314 . . . . 0.0 111.237 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.69 -37.14 75.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.159 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.427 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 83.7 m-85 -114.98 -34.34 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.022 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.66 42.96 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.924 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -113.97 -167.0 16.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.509 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.61 107.48 19.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.844 0.354 . . . . 0.0 111.063 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.06 -17.06 24.9 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.736 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -130.09 42.61 3.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.896 0.379 . . . . 0.0 110.904 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 t -146.54 107.72 4.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.656 ' HD3' HG22 ' A' ' 19' ' ' ILE . 0.5 OUTLIER -87.55 -50.68 6.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.051 179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.42 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 26.9 m -123.42 157.24 33.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 62.51 46.82 5.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.909 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 34.1 m . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.912 179.966 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.7 p . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.895 0.379 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.62 -55.27 28.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.075 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.52 -36.09 63.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.325 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -68.86 -25.5 64.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.05 28.47 8.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.146 -179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 m -90.09 161.78 36.97 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.756 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -89.72 22.79 25.96 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.871 0.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.1 60.29 50.21 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.969 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -85.82 -46.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.762 2.308 . . . . 0.0 112.626 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.9 m -83.38 175.11 10.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.959 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -79.21 -175.68 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.89 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 131.78 35.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.082 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.35 -24.87 29.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.486 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -107.13 164.58 12.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -123.4 -170.44 2.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 37.8 t -123.77 131.0 53.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.034 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.96 143.12 26.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.918 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.642 HG23 ' O ' ' A' ' 34' ' ' ASN . 1.5 pt -47.53 -28.53 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.816 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.19 -20.62 42.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.917 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 41.23 2.53 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.222 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -151.72 -175.92 5.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 47.8 m -122.48 164.18 18.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.744 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 176.14 -145.41 7.54 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.564 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.12 -170.42 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.868 0.366 . . . . 0.0 110.958 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.81 -173.9 25.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.511 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.43 -15.31 61.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.661 0.267 . . . . 0.0 111.45 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.4 -35.29 63.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.79 0.329 . . . . 0.0 111.393 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 85.5 m-85 -107.41 -31.29 8.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.171 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.4 m -108.67 26.45 10.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.044 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -64.13 -149.18 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.359 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.83 -36.34 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.372 . . . . 0.0 111.201 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.3 -20.61 5.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.744 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' ' 19' ' ' ILE . 81.0 m-20 -79.88 -30.52 40.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.784 0.326 . . . . 0.0 111.017 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 27.6 p -82.93 127.93 33.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.504 ' HB2' HG22 ' A' ' 19' ' ' ILE . 22.0 ttp180 -92.3 -37.38 12.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.044 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.49 153.18 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.893 0.377 . . . . 0.0 111.013 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 63.0 47.35 4.32 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.827 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.984 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.824 0.345 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.1 p -55.84 -25.57 42.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.288 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.738 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -61.85 -37.4 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.893 0.378 . . . . 0.0 111.131 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.93 -25.58 62.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.212 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -103.1 21.4 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.394 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.439 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.18 164.36 28.01 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.615 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 97.6 Cg_endo -85.23 25.87 11.7 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 123.745 -1.356 . . . . 0.0 113.278 0.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.03 60.49 45.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.523 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 88.8 Cg_endo -85.69 -45.07 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.828 2.352 . . . . 0.0 112.821 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.9 m -119.56 176.58 5.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.011 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -169.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.756 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.91 128.4 33.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.061 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -23.26 11.54 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.399 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -110.78 138.95 46.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.826 0.346 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.5 m -118.21 169.09 9.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.893 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 49.0 t -97.01 117.06 30.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.954 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 p -76.9 139.31 40.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.055 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.458 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.3 pp -46.25 -39.11 3.49 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.088 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.838 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.458 ' N ' HD12 ' A' ' 19' ' ' ILE . 1.9 m-85 -57.82 -21.13 40.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.977 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.62 46.12 1.56 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.166 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -153.52 137.5 16.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 111.181 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -77.03 158.56 30.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.778 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 172.78 -165.76 38.23 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.569 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.4 m -129.32 -170.25 2.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.83 -174.1 4.44 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.98 -24.8 58.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.79 0.329 . . . . 0.0 111.218 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.6 77.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.231 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -119.55 0.37 11.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.53 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.7 t -152.65 35.89 0.5 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.814 0.34 . . . . 0.0 110.842 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.71 171.68 16.19 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.7 116.38 4.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.792 0.329 . . . . 0.0 111.14 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.03 -24.42 18.86 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.614 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -131.01 42.96 3.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.854 0.359 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 53.6 t -128.12 106.81 9.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.096 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.738 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 14.3 ttt180 -79.92 -58.9 2.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.6 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.37 170.07 17.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.609 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.74 45.33 7.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.74 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.091 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.88 0.371 . . . . 0.0 110.808 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.7 t -73.14 -56.86 4.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.079 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.81 -35.91 64.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.287 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.93 -26.61 64.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mtm-85 -107.94 23.94 13.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.282 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -90.18 160.39 40.18 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.8 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -87.69 28.71 11.3 Favored 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 123.631 -1.404 . . . . 0.0 112.925 0.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.59 57.3 27.64 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 0.0 110.823 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -82.22 -31.52 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.638 2.225 . . . . 0.0 112.464 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.13 175.83 5.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.125 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -96.87 -170.91 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.81 123.18 27.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.919 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.07 -20.08 24.31 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.359 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -114.41 179.61 3.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.82 0.343 . . . . 0.0 110.783 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 76.4 m -150.85 147.84 27.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.002 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.07 126.05 34.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.1 t -86.97 141.34 28.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.036 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.427 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.3 pt -47.23 -28.47 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.11 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -65.11 -14.28 60.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.2 40.24 4.31 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.998 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -152.48 139.91 19.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.167 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.4 m -75.06 172.94 11.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.42 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.28 -147.08 12.17 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.469 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 t -156.71 -170.85 3.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.909 0.385 . . . . 0.0 110.941 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.27 -160.38 46.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.5 -28.19 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 111.201 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.49 -35.26 79.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.234 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.42 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 89.8 m-85 -109.9 -29.95 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.8 t -124.06 53.24 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -90.78 -120.98 2.35 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.456 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.64 -43.67 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.923 0.392 . . . . 0.0 111.144 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.07 -12.05 18.95 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.718 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -103.81 27.07 7.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.711 0.291 . . . . 0.0 111.035 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 10.7 p -122.95 124.26 42.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.995 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -80.57 -56.46 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.867 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -136.8 162.42 33.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.931 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.22 46.19 6.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.614 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.5 t . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.857 179.906 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.8 p . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.885 0.374 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.1 t -60.46 -31.63 70.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.936 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.21 -32.39 72.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.055 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 t -69.94 -22.3 63.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.167 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 75.6 mtm-85 -101.53 25.68 8.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -83.31 159.72 61.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.798 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -87.43 12.1 54.39 Favored 'Cis proline' 0 C--N 1.346 0.437 0 C-N-CA 123.472 -1.47 . . . . 0.0 112.802 0.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -126.45 65.61 59.97 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.751 0.31 . . . . 0.0 111.005 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -82.3 -43.0 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.685 2.256 . . . . 0.0 112.425 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.5 m -93.66 162.67 13.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.047 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.74 -169.84 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.762 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.89 128.92 34.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.036 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.97 -23.14 28.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.477 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.499 ' N ' HD12 ' A' ' 15' ' ' LEU . 1.9 mp -117.36 146.37 43.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.79 0.329 . . . . 0.0 110.902 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 m -111.88 171.84 7.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.34 124.07 40.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.428 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . 22.1 p -87.75 138.62 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.947 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.682 HG22 ' HB2' ' A' ' 36' ' ' ARG . 2.6 pt -46.99 -29.88 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.077 -179.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.401 ' N ' HG13 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -65.53 -14.11 60.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.214 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.9 41.07 3.91 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.101 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -155.97 146.24 21.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.839 0.352 . . . . 0.0 111.153 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.1 m -82.56 167.11 18.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.909 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.426 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 173.36 -152.37 15.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.577 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.8 p -149.21 -169.33 3.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.924 0.393 . . . . 0.0 111.045 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.66 -166.68 51.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.521 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.77 57.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.656 0.265 . . . . 0.0 111.455 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.16 -33.3 44.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.289 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.428 ' CD2' ' HB3' ' A' ' 18' ' ' SER . 48.1 m-85 -110.7 -30.51 7.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.1 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 67.0 m -118.86 37.67 4.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.821 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -88.65 -142.43 8.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.06 37.95 4.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 0.0 111.075 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -170.97 -41.21 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.419 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.515 ' O ' HG23 ' A' ' 19' ' ' ILE . 81.0 m-20 -80.28 -23.59 40.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.737 0.303 . . . . 0.0 111.08 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 22.6 p -79.98 106.25 11.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.032 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.682 ' HB2' HG22 ' A' ' 19' ' ' ILE . 27.5 ttp180 -80.25 -44.9 18.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.107 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.56 154.96 41.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.94 0.4 . . . . 0.0 111.293 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 63.72 46.92 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.112 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.906 0.384 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -95.54 -34.51 12.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.925 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.86 -40.25 96.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -26.34 66.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.413 ' HB3' ' HA ' ' A' ' 10' ' ' PRO . 2.7 mtt180 -79.87 -23.49 41.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.161 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -44.75 139.21 3.77 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -97.12 44.21 2.91 Favored 'Cis proline' 0 C--N 1.348 0.547 0 C-N-CA 124.388 -1.088 . . . . 0.0 113.21 0.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.457 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 2.3 mmt180 -143.42 51.99 1.89 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.638 0.256 . . . . 0.0 111.423 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.457 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 88.0 Cg_endo -82.78 -32.7 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.536 2.157 . . . . 0.0 112.565 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -141.36 171.09 14.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.63 -171.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.889 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.17 138.86 32.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.18 -28.22 12.43 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.471 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.725 HD23 ' O ' ' A' ' 24' ' ' GLY . 0.8 OUTLIER -97.98 161.71 13.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.807 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.4 m -133.13 163.69 28.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.0 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -100.96 128.51 46.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.711 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.5 p -90.05 143.08 27.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.227 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.488 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.4 pp -45.87 -37.5 2.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.101 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.875 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.488 ' N ' HD12 ' A' ' 19' ' ' ILE . 30.3 m-85 -56.42 -21.95 28.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.967 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.91 44.25 1.95 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.176 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -154.39 141.94 19.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.834 0.349 . . . . 0.0 111.191 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.81 168.94 18.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.818 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.725 ' O ' HD23 ' A' ' 15' ' ' LEU . . . 170.51 -147.3 10.48 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.529 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -159.96 -176.65 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.4 -157.91 23.46 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.46 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -86.6 8.24 23.04 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.77 -36.41 15.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.806 0.336 . . . . 0.0 111.238 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.47 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 30.1 m-85 -127.87 1.14 6.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.673 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 t -125.33 -29.0 3.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.659 0.266 . . . . 0.0 111.296 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -56.3 176.75 0.87 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.773 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.16 154.06 42.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.341 . . . . 0.0 111.114 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 58.12 22.08 48.33 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.39 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -160.1 32.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.786 0.327 . . . . 0.0 110.709 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 44.5 t -141.26 118.21 11.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.098 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -87.56 -37.7 16.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.771 179.759 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.9 t -150.3 157.63 43.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.712 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 67.54 46.68 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.615 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.813 -179.974 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.1 p . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.888 0.375 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.407 ' HB2' ' CG ' ' A' ' 10' ' ' PRO . 20.4 p -85.28 -31.78 22.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.65 -50.87 70.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -179.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.36 -23.69 63.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.296 -179.773 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 25.95 9.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.267 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.448 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.16 164.71 26.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.711 179.916 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 90.5 Cg_endo -86.19 21.86 21.42 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.693 -1.378 . . . . 0.0 113.087 0.43 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.32 61.75 59.2 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.349 . . . . 0.0 110.829 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.407 ' CG ' ' HB2' ' A' ' 3' ' ' CYS . 85.5 Cg_endo -86.32 -47.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.752 2.301 . . . . 0.0 112.813 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.8 m -110.45 -178.59 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.889 0.376 . . . . 0.0 111.029 -179.734 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -63.9 -177.31 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.866 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 134.37 36.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.105 -179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.83 -26.02 17.12 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -101.12 136.78 40.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.839 0.352 . . . . 0.0 110.956 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 30.3 m -104.57 161.81 13.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.851 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.9 t -97.79 106.34 18.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 p -67.1 139.9 57.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.83 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.4 pt -47.16 -33.77 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.797 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.84 -17.87 57.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.075 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.1 42.7 2.55 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.09 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -138.34 176.3 8.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 111.152 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -122.08 137.42 54.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.424 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -168.44 -158.87 12.97 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.548 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.6 p -142.31 -168.02 2.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.036 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.78 -169.88 19.76 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.511 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.409 ' HA ' ' CA ' ' A' ' 31' ' ' GLY . . . -76.2 -4.86 44.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.561 0.219 . . . . 0.0 111.582 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.93 -37.8 38.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.774 0.321 . . . . 0.0 111.24 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.424 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 66.7 m-85 -112.91 -28.06 7.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.385 -179.783 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.0 m -104.41 -23.1 13.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.409 ' CA ' ' HA ' ' A' ' 27' ' ' ALA . . . -57.51 155.33 19.04 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.617 -179.872 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.56 145.86 37.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.804 0.335 . . . . 0.0 111.137 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.41 26.75 69.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.504 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -159.91 30.58 0.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.755 0.312 . . . . 0.0 110.921 -179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.26 125.71 11.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.991 -179.864 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.98 -58.42 3.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.854 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.415 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -131.67 168.45 17.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.877 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 62.94 46.81 4.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.808 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.981 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.873 0 N-CA-C 112.281 0.475 . . . . 1.9399999999999999 112.281 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 63.4 p -148.51 40.21 0.92 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 1.6299999999999999 110.866 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -67.99 -50.75 53.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.02 110.973 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -29.84 59.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.92000000000000004 111.227 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.54 -26.61 64.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 1.3300000000000001 111.034 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -102.79 26.67 7.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 3.4500000000000002 111.079 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.402 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.7 m -83.92 162.17 53.18 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.417 . . . . 1.1599999999999999 110.794 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 83.7 Cg_endo -81.79 0.87 48.11 Favored 'Cis proline' 0 C--N 1.346 0.413 0 C-N-CA 123.383 -1.507 . . . . 0.94999999999999996 112.857 0.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.99 70.0 3.71 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 120.773 0.32 . . . . 3.6699999999999999 111.009 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.79 -44.23 0.38 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.616 2.211 . . . . 0.68000000000000005 112.407 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 97.0 m -113.1 -178.25 3.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.202 -0.454 . . . . 1.3200000000000001 110.973 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.9 -172.81 2.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 2.0099999999999998 110.86 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.87 140.22 36.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.60999999999999999 111.06 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.85 -28.18 12.88 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.792 -0.718 . . . . 0.56999999999999995 112.448 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.4 mp -106.48 158.59 16.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.825 0.345 . . . . 0.81000000000000005 110.82 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.3 m -128.03 150.6 49.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.5 110.929 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 19.4 t -87.38 126.39 34.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 1.03 110.862 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.3 t -92.46 137.32 32.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 1.28 110.865 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.482 HG22 ' HD3' ' A' ' 36' ' ' ARG . 1.4 pt -47.42 -31.34 2.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 0.70999999999999996 111.568 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -58.13 -21.85 48.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.292 -0.413 . . . . 2.0899999999999999 110.978 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 22' ' ' TYR . . . 104.92 39.18 2.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.722 -0.751 . . . . 0.58999999999999997 112.369 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 21' ' ' GLY . 74.8 m-85 -159.41 143.33 14.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.872 0.368 . . . . 1.5700000000000001 111.05 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.9 m -78.11 179.84 6.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.81000000000000005 110.814 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 160.57 -145.6 11.33 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.676 -0.773 . . . . 0.48999999999999999 112.57 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.91 -170.5 3.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.841 0.353 . . . . 1.4399999999999999 110.958 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.61 -160.52 28.78 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.48999999999999999 112.554 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.63 -28.76 28.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 0.55000000000000004 111.202 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.23 -35.04 72.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.435 . . . . 0.48999999999999999 111.167 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 97.7 m-85 -112.77 -33.15 6.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.228 -0.442 . . . . 1.3300000000000001 111.066 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -115.21 44.47 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 1.24 110.909 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -103.34 162.48 15.9 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.713 -0.755 . . . . 1.0800000000000001 112.526 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.5 103.52 1.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.81 0.338 . . . . 1.8400000000000001 111.122 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.59 -23.19 32.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.694 -0.765 . . . . 1.0600000000000001 112.619 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 -103.58 27.15 7.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.731 0.301 . . . . 1.25 110.968 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.6 p -137.41 124.27 21.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.357 -0.383 . . . . 1.1399999999999999 110.962 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.482 ' HD3' HG22 ' A' ' 19' ' ' ILE . 1.4 tpp180 -79.87 -37.84 34.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 2.1699999999999999 110.872 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 m -146.52 167.69 23.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.93000000000000005 110.942 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 61.84 46.11 7.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 1.8700000000000001 110.738 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 31.5 m -100.33 -31.65 11.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.991 -0.549 . . . . 1.29 110.882 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -82.49 -32.62 28.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.132 -0.486 . . . . 5.5300000000000002 110.905 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.376 -1.236 . . . . 3.0600000000000001 112.502 179.987 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 p -148.44 46.07 1.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 10' ' ' PRO . 23.9 p -69.88 -21.53 63.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.179 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.2 -31.67 65.7 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.839 0.352 . . . . 0.0 111.305 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.4 t -67.69 -19.4 65.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.455 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.2 mtp180 -112.34 31.57 6.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 111.283 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.7 m -69.01 162.22 66.72 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -91.63 8.77 62.54 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.845 -1.314 . . . . 0.0 112.909 0.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.6 mtm180 -135.01 66.91 69.23 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.0 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 93.5 Cg_endo -83.36 -42.87 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.733 2.289 . . . . 0.0 112.483 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.75 179.22 7.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.952 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.33 -171.6 3.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.801 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.11 134.04 35.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.047 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.68 -26.07 23.67 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.474 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -112.14 140.08 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.83 0.348 . . . . 0.0 110.892 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 38' ' ' GLN . 18.0 m -108.85 166.82 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.768 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 3.8 m -102.55 124.45 48.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.985 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.1 t -83.97 143.49 29.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.576 HG22 ' HB2' ' A' ' 36' ' ' ARG . 2.3 pp -47.8 -27.67 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.061 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -71.79 -5.91 37.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.541 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.86 6.35 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -133.73 179.37 6.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.855 0.36 . . . . 0.0 111.099 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -133.71 148.83 51.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.792 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.87 -137.06 2.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.616 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.9 t -155.34 -169.0 3.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.984 0.421 . . . . 0.0 110.975 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.83 -171.97 25.47 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.509 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.62 -9.88 59.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.559 0.219 . . . . 0.0 111.523 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.95 -37.0 56.11 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.8 0.333 . . . . 0.0 111.207 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -110.39 -27.4 9.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.112 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.3 m -111.37 29.92 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.989 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -108.01 159.27 14.46 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.517 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.15 119.98 16.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.123 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.2 -28.19 11.44 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -107.5 -27.91 10.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.787 0.327 . . . . 0.0 110.973 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 45.5 t -85.58 105.9 16.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.576 ' HB2' HG22 ' A' ' 19' ' ' ILE . 7.6 ttp180 -79.99 -47.8 14.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.264 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.23 160.95 33.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.938 0.399 . . . . 0.0 111.268 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.417 ' HB3' ' HA ' ' A' ' 16' ' ' CYS . 1.8 tm0? 62.31 46.17 6.18 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.821 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 m -103.03 -31.69 10.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.855 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -98.41 -32.06 11.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.978 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.413 -1.215 . . . . 0.0 112.544 -179.982 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.918 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.77 53.47 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.806 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.8 p -84.13 2.68 38.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.505 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.24 -30.35 68.47 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.786 0.327 . . . . 0.0 111.145 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 p -68.61 -22.05 64.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.317 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.15 29.93 6.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.798 0.332 . . . . 0.0 110.995 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.438 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.24 164.27 53.1 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.823 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 6.5 Cg_endo -87.52 4.06 69.21 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 124.064 -1.223 . . . . 0.0 112.859 0.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -127.64 69.54 75.88 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 120.924 0.392 . . . . 0.0 110.907 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -81.03 -43.2 0.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.622 2.215 . . . . 0.0 112.396 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 51.5 m -85.74 162.14 18.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -63.93 -173.59 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.13 134.3 36.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.075 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 105.83 -26.17 21.81 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.498 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.417 HD23 ' O ' ' A' ' 24' ' ' GLY . 2.6 mp -105.17 169.32 8.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.33 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 24.1 m -146.21 150.25 35.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.7 m -87.26 126.16 34.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.29 142.64 30.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.066 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.441 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.3 pt -47.17 -32.01 2.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.828 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -61.75 -18.41 59.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.083 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.81 40.21 2.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.064 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -139.38 -176.58 4.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.795 0.331 . . . . 0.0 110.94 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.4 t -132.5 155.59 48.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.417 ' O ' HD23 ' A' ' 15' ' ' LEU . . . 173.91 -132.28 2.24 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.547 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.07 -172.01 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.857 0.36 . . . . 0.0 110.912 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.41 -160.21 46.9 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.46 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.91 -29.55 29.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.784 0.326 . . . . 0.0 111.099 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.05 79.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.227 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -108.18 -29.73 8.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.007 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 2.0 t -120.38 39.53 3.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.098 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.62 171.79 53.01 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.352 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.46 65.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.897 0.38 . . . . 0.0 111.038 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.14 28.54 7.21 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.345 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -148.78 28.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.789 0.328 . . . . 0.0 110.938 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.1 p -124.6 123.14 39.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.2 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.441 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.5 tpp180 -79.93 -41.8 25.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.48 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 9.9 m -151.61 161.23 43.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.45 46.43 5.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.021 0.439 . . . . 0.0 110.617 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 59.9 m -79.33 -30.74 42.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.913 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.64 -31.32 52.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.875 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.516 -179.963 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.406 ' HG1' ' HB2' ' A' ' 5' ' ' SER . 2.9 t -151.58 43.57 0.75 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.92 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.1 p -65.54 -25.45 67.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.038 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -69.72 -35.32 74.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.865 0.364 . . . . 0.0 111.348 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.406 ' HB2' ' HG1' ' A' ' 2' ' ' THR . 19.5 m -64.59 -15.9 61.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.734 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -123.34 37.94 4.3 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.669 0.271 . . . . 0.0 111.374 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.9 m -74.17 160.05 82.44 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.767 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -89.65 6.83 68.34 Favored 'Cis proline' 0 N--CA 1.46 -0.482 0 C-N-CA 123.576 -1.426 . . . . 0.0 112.753 0.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.95 77.52 62.24 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -79.51 -30.29 2.55 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.603 2.202 . . . . 0.0 112.616 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.1 m -115.08 175.28 5.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.053 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -63.45 -170.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.923 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 133.6 36.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.76 -26.35 18.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.44 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.93 165.11 14.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.801 0.334 . . . . 0.0 110.835 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.6 m -143.07 149.66 38.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.11 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.1 t -90.37 109.04 20.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.527 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.4 p -74.44 140.03 44.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.108 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.51 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 2.0 pp -46.98 -34.36 2.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.87 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -59.64 -19.4 48.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.067 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.21 41.02 2.68 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.044 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -137.27 173.98 11.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.9 0.381 . . . . 0.0 111.02 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.25 129.03 49.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.841 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -162.62 -145.17 4.25 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.483 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 t -142.79 -172.98 3.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.81 -162.43 11.35 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.464 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.73 -26.2 54.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.77 0.319 . . . . 0.0 111.26 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.53 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.342 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.0 m-85 -127.43 5.57 6.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.9 t -150.65 30.52 0.66 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.878 0.37 . . . . 0.0 110.924 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.07 -171.6 47.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.544 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -76.83 -32.23 57.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.67 16.63 12.39 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.667 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -141.73 33.83 1.61 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.786 0.327 . . . . 0.0 110.75 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.9 t -136.22 104.33 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.198 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.51 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.5 OUTLIER -79.92 -52.58 7.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.719 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.48 164.2 21.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 61.37 45.86 8.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.788 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.3 m -106.63 -30.36 9.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.925 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -109.88 29.58 7.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.902 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.386 -1.23 . . . . 0.0 112.498 179.965 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.885 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.0 p -112.15 32.26 5.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.882 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.1 t -64.56 -48.52 74.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.931 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.11 -37.6 85.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.125 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 m -68.78 -28.73 67.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.063 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.61 28.06 7.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.018 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.412 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 3.4 m -90.0 162.63 34.8 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.851 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.412 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 80.6 Cg_endo -89.21 17.31 41.46 Favored 'Cis proline' 0 C--N 1.347 0.466 0 C-N-CA 123.66 -1.392 . . . . 0.0 112.893 0.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -129.32 63.4 67.39 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.922 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -82.84 -43.01 0.09 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.693 2.262 . . . . 0.0 112.357 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.2 m -94.62 163.68 13.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.899 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -74.05 -173.33 1.58 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.836 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.08 133.37 36.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.08 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 -25.68 25.56 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.54 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -109.49 137.46 47.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.355 . . . . 0.0 110.9 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 74.6 m -107.73 151.09 26.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.844 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.1 119.6 33.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.046 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.434 ' HB2' ' CD2' ' A' ' 29' ' ' TYR . 0.4 OUTLIER -77.98 146.18 35.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.702 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.461 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.9 pt -44.58 -30.18 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.033 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.405 ' N ' HG13 ' A' ' 19' ' ' ILE . 2.8 m-85 -59.91 -18.98 49.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.957 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.21 41.96 3.35 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.044 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -150.56 144.35 25.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.928 0.394 . . . . 0.0 111.404 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 m -79.67 158.2 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.917 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.421 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . -178.89 -139.36 3.53 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.563 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.01 -170.93 3.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 0.0 110.97 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.34 -166.71 10.85 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.542 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.18 -27.34 47.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.795 0.331 . . . . 0.0 111.184 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.14 73.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.128 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.434 ' CD2' ' HB2' ' A' ' 18' ' ' SER . 10.8 m-85 -109.54 -27.4 9.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.004 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.4 t -122.18 48.29 1.76 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.009 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -122.54 159.22 17.19 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.498 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.15 116.48 3.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.791 0.329 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.19 -16.69 45.4 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.662 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.416 ' HA ' HG12 ' A' ' 19' ' ' ILE . 50.8 m-20 -132.11 44.12 2.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.881 0.372 . . . . 0.0 110.843 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 50.1 t -127.2 105.8 8.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.107 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.461 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -79.79 -57.53 3.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.792 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.5 m -143.88 169.5 17.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.876 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 61.86 46.16 7.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.684 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -24.6 34.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.993 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -30.79 64.61 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.968 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.373 -1.237 . . . . 0.0 112.484 179.954 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.899 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p -153.25 35.88 0.47 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.821 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.403 ' HB2' ' CB ' ' A' ' 10' ' ' PRO . 7.5 p -62.41 -30.91 71.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -57.04 -39.19 74.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.297 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 t -70.32 -21.04 62.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.215 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -97.24 23.07 7.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.148 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.5 m -70.52 161.09 78.92 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.832 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -84.71 1.37 62.02 Favored 'Cis proline' 0 C--N 1.347 0.469 0 C-N-CA 123.475 -1.469 . . . . 0.0 112.862 0.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -126.5 76.75 73.66 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.768 0.318 . . . . 0.0 110.967 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.403 ' CB ' ' HB2' ' A' ' 3' ' ' CYS . 16.0 Cg_exo -67.98 -66.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.746 2.298 . . . . 0.0 112.337 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.1 m -95.95 179.77 4.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.039 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.39 -170.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.952 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.96 137.03 36.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.005 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.14 -28.23 12.46 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.446 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.04 169.81 9.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.8 0.333 . . . . 0.0 110.853 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.4 m -141.97 150.35 41.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 43.1 t -98.22 108.22 20.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.25 137.52 46.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.853 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.478 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.0 pt -46.11 -33.19 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.903 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.54 -20.31 45.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.019 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 101.18 41.91 2.5 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.142 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 6.5 m-85 -148.01 146.49 28.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 111.171 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -91.65 152.77 20.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.773 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.27 -144.62 5.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.577 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.0 t -157.45 -169.87 3.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.834 0.349 . . . . 0.0 110.936 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.35 -167.56 18.17 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.511 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.62 -12.25 60.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.686 0.279 . . . . 0.0 111.525 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.75 -34.31 66.93 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.791 0.329 . . . . 0.0 111.194 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -116.74 -21.02 9.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.515 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 -12.16 14.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.669 -0.242 . . . . 0.0 111.477 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.7 162.85 44.57 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.497 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.58 149.86 49.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.834 0.349 . . . . 0.0 111.121 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.29 24.15 58.62 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.527 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -160.06 39.71 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.846 0.355 . . . . 0.0 110.846 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 25.9 p -159.97 120.29 2.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.078 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.478 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 9.5 ttm180 -79.82 -56.92 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.3 m -123.85 165.81 16.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.071 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.42 46.97 4.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.862 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -131.2 -44.98 1.02 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.921 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.18 -29.58 19.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.911 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.415 -1.214 . . . . 0.0 112.456 179.969 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.889 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.3 p -138.97 40.88 2.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.911 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.2 t -74.66 -43.69 54.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.914 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.518 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -63.2 -40.32 97.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.131 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.1 m -70.16 -23.85 63.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.275 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -98.07 23.66 7.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.115 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.3 m -78.89 161.52 68.43 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.636 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -87.46 4.34 69.15 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.706 -1.372 . . . . 0.0 112.987 0.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.32 73.67 67.47 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-O 120.869 0.366 . . . . 0.0 111.085 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HG3' ' HB2' ' A' ' 17' ' ' CYS . 72.7 Cg_endo -76.85 -42.97 0.28 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.565 2.177 . . . . 0.0 112.243 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.9 m -114.03 176.9 4.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.971 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.48 -174.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.969 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 146.76 31.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.098 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.93 -25.18 28.27 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.486 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.47 154.23 20.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.816 0.341 . . . . 0.0 110.905 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.9 m -120.03 150.56 40.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.963 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.414 ' HB2' ' HG3' ' A' ' 10' ' ' PRO . 18.4 t -84.56 113.7 21.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.998 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.44 137.64 37.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.759 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 29.5 pt -45.72 -37.0 2.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.824 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -56.54 -22.43 33.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.965 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 22' ' ' TYR . . . 103.93 41.04 2.19 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.184 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.408 ' CD1' ' O ' ' A' ' 21' ' ' GLY . 20.7 m-85 -153.67 143.03 21.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.817 0.342 . . . . 0.0 111.149 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 60.3 m -77.52 169.44 18.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.435 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 168.07 -150.42 16.4 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.417 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -152.44 -169.49 3.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.935 0.398 . . . . 0.0 111.004 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.19 -160.2 35.76 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.5 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.78 -30.6 26.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.859 0.361 . . . . 0.0 111.16 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -35.62 72.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.435 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 53.2 m-85 -110.63 -28.5 8.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.042 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -124.8 47.55 2.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 110.952 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -104.02 165.27 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.436 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.28 92.59 1.04 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 111.102 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.0 16.03 14.76 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.651 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -137.05 12.8 3.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.607 0.241 . . . . 0.0 111.232 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.3 p -127.43 137.98 52.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.873 0.368 . . . . 0.0 110.864 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.518 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -79.97 -53.52 6.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.945 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 31.6 p -149.55 169.03 21.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 64.52 47.73 2.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.792 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 4.6 m -102.46 26.34 7.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.953 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -82.67 -33.01 27.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.869 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 CA-C-O 118.397 -1.224 . . . . 0.0 112.477 179.997 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.887 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t -148.79 34.31 0.76 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.854 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 t -64.88 -47.64 77.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.974 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.41 86.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.128 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.38 -22.75 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.093 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.89 28.32 7.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.806 0.336 . . . . 0.0 111.059 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.404 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.9 m -80.77 162.88 58.6 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.778 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.404 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 81.2 Cg_endo -89.62 14.12 51.11 Favored 'Cis proline' 0 C--N 1.347 0.497 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.819 0.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.28 63.42 67.39 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.808 0.337 . . . . 0.0 110.972 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -84.12 -44.06 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.726 2.284 . . . . 0.0 112.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.455 ' HB3' HD12 ' A' ' 15' ' ' LEU . 56.3 m -82.08 154.6 25.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.898 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.4 -170.85 0.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.832 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.84 120.29 24.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.069 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.99 -12.27 17.39 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.765 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.455 HD12 ' HB3' ' A' ' 11' ' ' CYS . 0.0 OUTLIER -134.35 139.57 45.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.839 0.352 . . . . 0.0 110.974 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -92.94 -178.1 4.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.0 t -113.51 123.22 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.789 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.2 p -83.93 145.8 28.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.402 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.536 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 6.8 pt -46.66 -27.18 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.105 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.085 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.401 ' N ' HG13 ' A' ' 19' ' ' ILE . 20.6 m-85 -75.0 0.65 15.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.607 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.96 37.59 18.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.017 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -129.6 178.41 6.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 111.053 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.403 ' O ' ' CE1' ' A' ' 29' ' ' TYR . 71.1 m -126.79 157.86 38.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.85 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.408 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 169.84 -147.89 11.31 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.623 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.16 -168.01 2.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.967 0.413 . . . . 0.0 111.046 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.35 -165.79 26.82 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.521 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 -27.48 54.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.789 0.328 . . . . 0.0 111.112 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.51 75.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.408 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 88.0 m-85 -107.58 -30.19 8.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.109 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.4 m -115.09 38.92 3.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.987 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.49 -166.99 40.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.439 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -91.38 -35.7 14.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.893 0.378 . . . . 0.0 111.155 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.67 23.46 29.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.494 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -153.98 43.96 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 7.6 t -125.54 102.79 7.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.041 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.536 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 2.9 tpt180 -79.84 -46.25 17.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.825 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.3 m -150.1 168.38 24.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 62.48 46.15 5.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.813 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.7 m -97.57 -30.8 12.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.927 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.86 -31.09 28.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.893 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.381 -1.233 . . . . 0.0 112.453 -179.967 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.887 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.8 p -131.03 43.11 3.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.807 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 t -86.35 -49.07 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.968 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.91 71.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.191 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.6 -27.43 66.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.065 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.95 28.99 7.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.972 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.416 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.8 m -89.97 163.03 33.71 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.741 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 76.9 Cg_endo -87.81 4.84 69.33 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.655 -1.394 . . . . 0.0 112.907 0.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -120.84 66.9 14.28 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.362 . . . . 0.0 111.113 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -77.58 -43.33 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.58 2.187 . . . . 0.0 112.481 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.0 m -105.87 171.7 7.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.06 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.9 -170.02 2.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.935 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.92 134.04 36.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.011 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.07 -26.79 9.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.367 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.4 mp -114.63 147.38 39.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.869 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.7 m -119.95 146.35 45.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.858 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.5 t -85.13 119.18 25.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.744 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.8 t -77.76 145.27 36.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.015 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.4 pt -46.79 -26.01 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.104 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.45 9.74 6.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.532 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.8 44.76 37.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.621 -0.8 . . . . 0.0 112.278 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -145.52 122.17 11.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.809 0.338 . . . . 0.0 111.205 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -73.3 170.04 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.775 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.426 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 158.66 -152.7 23.83 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.596 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.5 p -145.11 -168.21 2.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.92 0.391 . . . . 0.0 111.06 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.33 -169.94 42.87 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.503 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.39 -16.35 58.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.682 0.277 . . . . 0.0 111.435 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.03 -34.02 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.759 0.314 . . . . 0.0 111.309 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.426 ' CD2' ' HA3' ' A' ' 24' ' ' GLY . 74.1 m-85 -107.96 -33.66 7.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.204 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.7 m -108.71 28.2 8.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.044 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -79.73 -174.84 47.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.557 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.35 -33.01 16.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.35 . . . . 0.0 111.066 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.55 19.66 44.34 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.602 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -152.79 48.45 0.73 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.861 0.362 . . . . 0.0 110.726 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.3 t -126.35 103.32 7.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.975 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -79.89 -54.79 5.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.7 m -138.56 170.31 16.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.943 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.39 47.37 3.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.72 25.35 7.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.0 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -147.71 30.7 0.89 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.847 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.399 -1.223 . . . . 0.0 112.524 -179.993 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.863 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p -141.39 45.28 1.74 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.804 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 19.4 p -79.67 -21.03 45.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.186 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.624 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -53.87 -26.38 24.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.728 0.299 . . . . 0.0 111.389 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.6 p -74.24 -14.48 60.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.523 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -96.02 9.62 40.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.573 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.27 144.16 83.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.428 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -95.78 26.85 19.38 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.315 -1.119 . . . . 0.0 112.968 0.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.474 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 11.8 mtm-85 -130.82 53.4 11.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.662 0.268 . . . . 0.0 111.355 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.482 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 95.6 Cg_endo -84.9 -43.59 0.06 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.573 2.182 . . . . 0.0 112.714 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 t -100.0 170.75 8.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.107 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -81.8 -174.63 5.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.02 129.37 34.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.096 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.7 -22.41 37.3 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.616 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.6 166.52 11.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 110.981 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -132.98 155.04 49.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.765 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.63 103.69 16.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.844 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.49 140.56 56.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.001 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.407 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.1 pp -45.87 -39.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.806 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.407 ' N ' HD12 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -56.61 -22.41 33.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.988 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.89 45.93 1.44 Allowed Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.119 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -152.77 133.03 13.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.875 0.369 . . . . 0.0 111.158 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 m -70.25 162.18 28.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.843 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 168.52 -159.44 32.6 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.53 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -144.81 -177.37 5.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.796 0.332 . . . . 0.0 110.846 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.62 -169.87 8.13 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.3 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.51 -15.88 61.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.61 0.243 . . . . 0.0 111.371 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.57 78.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.717 0.294 . . . . 0.0 111.414 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -133.37 17.0 4.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 6.4 t -160.08 30.2 0.17 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.825 0.345 . . . . 0.0 110.902 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.05 176.93 32.26 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.502 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.12 109.28 2.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.823 0.344 . . . . 0.0 111.075 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.23 -23.06 37.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.617 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -107.94 29.93 6.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.813 0.34 . . . . 0.0 110.883 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.7 t -129.04 118.22 22.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.624 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 0.9 OUTLIER -81.02 -64.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.966 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.406 ' CB ' ' HG3' ' A' ' 10' ' ' PRO . 80.6 m -127.4 163.84 23.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.872 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 63.4 46.68 4.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.82 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 m -100.75 23.54 10.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.12 -33.46 7.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.878 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.509 -179.984 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . 0.465 ' O ' HG23 ' A' ' 2' ' ' THR . . . . . . . . 0 N--CA 1.441 -0.902 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 1' ' ' PCA . 24.4 p -158.8 45.11 0.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.792 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.7 t -73.64 -40.89 63.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.33 -32.63 74.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.145 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -68.91 -26.44 65.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.037 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 mtp180 -106.22 28.98 7.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.958 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.444 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.3 m -85.03 164.7 40.53 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.444 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 79.0 Cg_endo -86.67 2.84 68.1 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.65 -1.396 . . . . 0.0 112.915 0.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -124.34 68.96 50.49 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 0.0 111.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.98 -27.28 2.55 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.617 2.211 . . . . 0.0 112.579 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -109.2 171.72 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.072 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -71.58 -174.22 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 133.46 36.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.97 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.82 -26.82 11.08 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.336 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.8 170.29 7.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.749 0.309 . . . . 0.0 110.803 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.2 m -141.62 161.33 38.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.933 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.7 t -93.72 132.74 37.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.088 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -93.68 138.4 31.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.891 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.443 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.2 pp -45.69 -38.12 2.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.819 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.443 ' N ' HD12 ' A' ' 19' ' ' ILE . 99.1 m-85 -57.0 -22.16 36.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.074 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.05 41.41 2.11 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.072 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -154.27 141.01 19.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.854 0.359 . . . . 0.0 111.034 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.6 m -74.18 175.57 7.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.899 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.418 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.2 -146.65 11.68 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.427 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 m -155.49 -170.89 3.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.886 0.374 . . . . 0.0 110.967 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.16 -160.91 42.16 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.441 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.58 -29.93 25.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.737 0.303 . . . . 0.0 111.087 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.15 -36.31 79.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.208 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.418 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 79.2 m-85 -108.12 -29.77 8.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.008 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 5.0 t -126.33 48.83 2.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.96 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.64 -146.34 19.69 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.411 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -119.98 76.16 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 111.038 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.05 -27.94 3.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.401 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -98.08 21.74 10.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.675 0.274 . . . . 0.0 111.042 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 19.6 p -120.22 135.31 55.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.35 . . . . 0.0 110.913 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.409 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.2 OUTLIER -79.97 -39.94 29.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.866 179.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.8 m -148.75 166.12 29.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.28 46.75 2.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.8 m -102.74 -28.41 12.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.963 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.52 24.73 7.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.922 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.403 -1.22 . . . . 0.0 112.489 180.0 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.916 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.9 p -148.63 44.11 1.01 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.783 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.7 t -78.51 -32.73 48.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.903 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.21 86.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.058 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 p -70.26 -22.71 62.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.02 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.1 mtp180 -79.92 -21.47 43.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.134 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.2 m -52.68 160.24 1.47 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.951 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -90.35 18.75 38.3 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.897 0.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.18 66.32 45.28 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.748 0.309 . . . . 0.0 111.231 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -71.85 -42.73 1.51 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.771 2.314 . . . . 0.0 112.261 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.8 m -122.15 172.17 8.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.103 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -171.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.896 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 140.03 36.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.045 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.28 -27.95 14.17 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.432 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.78 171.77 8.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.813 0.34 . . . . 0.0 110.916 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.6 m -146.89 159.37 43.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.836 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 18.2 t -98.33 127.28 44.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.857 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 t -88.91 139.34 30.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.95 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 21.1 pt -46.01 -36.72 2.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.823 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -19.66 29.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.083 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.77 46.53 1.92 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.112 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -154.13 142.99 21.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.915 0.388 . . . . 0.0 111.283 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.4 ' O ' ' CD2' ' A' ' 29' ' ' TYR . 0.5 OUTLIER -81.59 170.66 15.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.797 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.437 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 159.81 -150.27 20.45 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.578 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.1 t -148.42 -170.06 3.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.912 0.386 . . . . 0.0 110.994 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.39 -157.14 37.42 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.516 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.48 -26.76 29.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 0.0 111.194 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.26 75.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.17 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.437 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 34.2 m-85 -116.56 -17.96 10.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.447 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -129.81 32.25 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.761 0.315 . . . . 0.0 110.958 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.15 177.52 39.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.506 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.67 132.12 42.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.86 0.362 . . . . 0.0 111.14 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 59.19 24.56 58.88 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.468 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -143.28 23.48 1.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.713 0.292 . . . . 0.0 111.134 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 28.2 p -131.36 125.73 33.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.015 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.85 -43.95 21.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.974 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -136.34 167.66 20.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.961 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 61.64 45.82 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.793 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.1 m -104.2 -31.87 9.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.875 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -143.69 30.93 1.32 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.902 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.385 -1.231 . . . . 0.0 112.5 179.966 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.912 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.2 p 63.14 49.92 3.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.618 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.8 m -49.38 -54.73 15.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.231 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -52.8 -41.71 64.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.241 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.8 t -67.26 -27.39 67.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.032 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.3 mtm105 -118.41 30.07 7.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.04 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.429 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 1.6 m -84.98 164.2 42.75 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.726 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 72.6 Cg_endo -89.83 19.98 33.94 Favored 'Cis proline' 0 C--N 1.347 0.495 0 C-N-CA 123.791 -1.337 . . . . 0.0 112.936 0.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.414 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 31.8 mtp180 -137.59 64.82 45.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.701 0.286 . . . . 0.0 111.199 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 17.3 Cg_exo -67.1 -51.66 0.75 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.585 2.19 . . . . 0.0 112.104 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.03 -177.06 4.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.915 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -72.43 -174.99 1.47 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 139.96 35.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.113 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.72 -25.25 28.14 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.448 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -108.36 144.06 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.831 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.3 m -108.58 139.78 42.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.744 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.88 106.37 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.846 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 35' ' ' CYS . 18.8 p -66.24 140.82 58.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.034 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 34' ' ' ASN . 2.3 pp -48.12 -33.71 4.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.655 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -56.71 -22.87 38.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.032 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.27 41.44 1.78 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.38 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -158.81 134.51 8.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.838 0.351 . . . . 0.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.2 p -90.67 152.12 20.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.436 ' N ' ' CD2' ' A' ' 29' ' ' TYR . . . -174.43 -136.37 2.23 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.484 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -147.92 -169.9 3.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.915 0.388 . . . . 0.0 110.919 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.44 -161.38 45.59 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.499 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.25 -25.87 36.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.771 0.32 . . . . 0.0 111.219 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.29 -35.31 80.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.239 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.436 ' CD2' ' N ' ' A' ' 24' ' ' GLY . 54.3 m-85 -108.91 -37.97 5.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.073 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 77.8 m -114.04 47.97 1.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.949 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -97.67 -155.75 30.01 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.478 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.7 115.32 29.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.856 0.36 . . . . 0.0 111.078 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.06 10.7 86.03 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.764 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.445 ' O ' HG23 ' A' ' 19' ' ' ILE . 39.7 m-20 -113.33 -29.92 7.08 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.783 0.325 . . . . 0.0 110.971 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 18' ' ' SER . 28.1 p -83.78 129.1 34.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.106 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.443 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 4.7 ttp180 -79.72 -54.47 5.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.813 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 17.3 m -127.9 163.01 25.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 62.45 46.72 5.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.778 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 73.7 m -92.79 -28.77 16.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.987 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.86 27.29 7.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.919 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.394 -1.225 . . . . 0.0 112.461 179.985 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.863 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.2 p -103.64 27.72 7.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.0 t -65.45 -47.83 74.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.983 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.665 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -58.11 -21.95 48.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.335 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.56 -22.06 63.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.293 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -103.56 25.71 9.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.778 0.323 . . . . 0.0 111.312 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.76 142.46 91.18 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.341 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -97.53 22.11 25.58 Favored 'Cis proline' 0 N--CA 1.457 -0.623 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.066 0.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 65.28 69.48 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.845 0.355 . . . . 0.0 111.405 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.24 -26.8 3.97 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.599 2.199 . . . . 0.0 112.435 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 m -137.01 -179.82 5.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.0 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.85 -171.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.979 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.01 135.36 36.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.014 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.03 -27.31 17.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mp -108.62 122.18 46.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.859 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.2 m -97.82 159.56 14.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.901 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 48.8 t -94.7 118.45 31.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.7 t -80.04 139.6 36.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.045 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.409 HG22 ' HG3' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -45.6 -32.04 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.651 -179.9 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.71 -22.37 34.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.925 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.71 37.21 3.05 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.22 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -156.08 144.4 19.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 68.2 m -74.58 175.07 8.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.898 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.416 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 166.36 -148.51 13.64 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.474 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 78.8 p -150.57 -170.52 3.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.75 -164.09 17.64 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.53 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.87 -29.19 32.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.796 0.332 . . . . 0.0 111.173 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.6 72.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.18 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.416 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 84.9 m-85 -109.82 -28.53 8.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.997 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.9 t -127.7 50.44 2.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.884 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -125.53 170.47 17.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.531 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.15 124.87 21.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.858 0.361 . . . . 0.0 111.092 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.66 2.49 85.5 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -137.68 37.41 2.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 26.2 p -143.66 110.89 5.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.665 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 4.2 ttt180 -80.22 -62.93 1.53 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 80.0 m -118.95 157.58 27.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.9 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 62.24 46.42 6.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.794 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.5 t -114.6 -36.35 4.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.964 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.9 tpt85 -78.0 -32.43 51.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.935 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.365 -1.242 . . . . 0.0 112.477 179.993 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.91 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p 58.18 38.11 26.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.755 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 10' ' ' PRO . 6.4 p -62.23 -26.11 68.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.254 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -71.58 -31.11 66.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.0 p -70.67 -12.66 61.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.704 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -110.04 25.12 12.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.683 0.278 . . . . 0.0 111.425 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.439 ' SG ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -64.11 148.52 95.34 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.323 179.48 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 71.2 Cg_endo -98.31 20.35 26.1 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 C-N-CA 124.432 -1.07 . . . . 0.0 113.081 0.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -137.06 67.33 55.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.749 0.309 . . . . 0.0 111.033 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.46 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 85.6 Cg_endo -83.59 -44.48 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.596 2.197 . . . . 0.0 112.695 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 m -109.04 166.46 10.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -67.83 -171.22 0.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.796 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 128.64 33.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.095 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 113.49 -22.52 15.05 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.611 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.4 mp -109.7 169.18 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.84 0.352 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.2 m -140.24 178.0 7.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.931 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.42 ' HB3' ' HB2' ' A' ' 37' ' ' CYS . 39.7 t -112.9 118.45 34.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.813 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.6 p -87.63 137.5 32.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.113 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.656 HG22 ' HD3' ' A' ' 36' ' ' ARG . 1.9 pp -46.88 -32.15 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.69 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -56.73 -21.57 29.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.967 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.17 42.44 2.23 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.162 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -149.09 175.6 11.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.166 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 7.2 t -116.84 157.17 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.427 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 173.91 -149.13 10.58 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.485 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.8 m -147.04 -170.02 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.897 0.38 . . . . 0.0 111.0 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.08 -160.04 22.26 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.543 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.95 -24.34 38.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.76 0.314 . . . . 0.0 111.237 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.69 -37.14 75.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.159 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.427 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 83.7 m-85 -114.98 -34.34 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.022 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.66 42.96 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.924 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -113.97 -167.0 16.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.509 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.61 107.48 19.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.844 0.354 . . . . 0.0 111.063 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.06 -17.06 24.9 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.736 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -130.09 42.61 3.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.896 0.379 . . . . 0.0 110.904 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 t -146.54 107.72 4.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.656 ' HD3' HG22 ' A' ' 19' ' ' ILE . 0.5 OUTLIER -87.55 -50.68 6.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.051 179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.42 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 26.9 m -123.42 157.24 33.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 62.51 46.82 5.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.909 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 34.1 m -101.13 -31.57 10.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.912 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ptt-85 -79.2 -30.96 43.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.852 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.386 -1.23 . . . . 0.0 112.494 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.871 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.7 p -130.11 42.97 3.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.749 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.62 -55.27 28.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.075 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.52 -36.09 63.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.325 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -68.86 -25.5 64.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.05 28.47 8.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.146 -179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 m -90.09 161.78 36.97 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.756 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -89.72 22.79 25.96 Favored 'Cis proline' 0 C--N 1.348 0.531 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.871 0.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.1 60.29 50.21 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.969 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -85.82 -46.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.762 2.308 . . . . 0.0 112.626 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.9 m -83.38 175.11 10.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.959 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 -79.21 -175.68 4.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.89 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.94 131.78 35.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.082 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.35 -24.87 29.62 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.486 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -107.13 164.58 12.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 m -123.4 -170.44 2.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 37.8 t -123.77 131.0 53.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.034 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -93.96 143.12 26.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.918 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.642 HG23 ' O ' ' A' ' 34' ' ' ASN . 1.5 pt -47.53 -28.53 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.816 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.19 -20.62 42.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.917 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 41.23 2.53 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.222 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -151.72 -175.92 5.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.885 0.374 . . . . 0.0 111.154 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 47.8 m -122.48 164.18 18.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.744 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 176.14 -145.41 7.54 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.564 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -149.12 -170.42 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.868 0.366 . . . . 0.0 110.958 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.81 -173.9 25.99 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.511 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -73.43 -15.31 61.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.661 0.267 . . . . 0.0 111.45 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.4 -35.29 63.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.79 0.329 . . . . 0.0 111.393 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.423 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 85.5 m-85 -107.41 -31.29 8.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.171 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.4 m -108.67 26.45 10.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.044 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -64.13 -149.18 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.359 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.83 -36.34 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.372 . . . . 0.0 111.201 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.3 -20.61 5.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.744 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' ' 19' ' ' ILE . 81.0 m-20 -79.88 -30.52 40.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.784 0.326 . . . . 0.0 111.017 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 27.6 p -82.93 127.93 33.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.93 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.504 ' HB2' HG22 ' A' ' 19' ' ' ILE . 22.0 ttp180 -92.3 -37.38 12.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.044 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.49 153.18 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.893 0.377 . . . . 0.0 111.013 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 63.0 47.35 4.32 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.827 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.3 m -91.99 -35.22 14.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.951 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -91.1 -31.22 16.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.913 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.399 -1.223 . . . . 0.0 112.496 -179.987 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.916 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 p 58.14 34.97 24.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.969 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.1 p -55.84 -25.57 42.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.288 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.738 ' HB2' ' HD3' ' A' ' 36' ' ' ARG . . . -61.85 -37.4 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.893 0.378 . . . . 0.0 111.131 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.93 -25.58 62.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.212 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -103.1 21.4 15.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.394 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.439 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.18 164.36 28.01 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.615 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 97.6 Cg_endo -85.23 25.87 11.7 Favored 'Cis proline' 0 C--N 1.349 0.567 0 C-N-CA 123.745 -1.356 . . . . 0.0 113.278 0.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.03 60.49 45.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.523 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 7' ' ' CYS . 88.8 Cg_endo -85.69 -45.07 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.828 2.352 . . . . 0.0 112.821 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.9 m -119.56 176.58 5.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.011 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 -169.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.756 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.91 128.4 33.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.061 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -23.26 11.54 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.399 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mp -110.78 138.95 46.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.826 0.346 . . . . 0.0 110.97 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.5 m -118.21 169.09 9.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.893 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 49.0 t -97.01 117.06 30.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.954 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 p -76.9 139.31 40.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.055 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.458 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.3 pp -46.25 -39.11 3.49 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.088 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.838 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.458 ' N ' HD12 ' A' ' 19' ' ' ILE . 1.9 m-85 -57.82 -21.13 40.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.977 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.62 46.12 1.56 Allowed Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.166 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -153.52 137.5 16.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 111.181 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -77.03 158.56 30.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.778 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 172.78 -165.76 38.23 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.569 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.4 m -129.32 -170.25 2.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.879 0.371 . . . . 0.0 110.903 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.83 -174.1 4.44 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.98 -24.8 58.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.79 0.329 . . . . 0.0 111.218 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.6 77.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.231 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -119.55 0.37 11.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.53 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.7 t -152.65 35.89 0.5 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.814 0.34 . . . . 0.0 110.842 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.71 171.68 16.19 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.501 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.7 116.38 4.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.792 0.329 . . . . 0.0 111.14 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.03 -24.42 18.86 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.614 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -131.01 42.96 3.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.854 0.359 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 53.6 t -128.12 106.81 9.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.096 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.738 ' HD3' ' HB2' ' A' ' 4' ' ' ALA . 14.3 ttt180 -79.92 -58.9 2.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.6 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.37 170.07 17.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.609 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.74 45.33 7.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.007 0.432 . . . . 0.0 110.74 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -20.94 47.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.091 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -29.04 62.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.025 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.089 0 CA-C-O 118.365 -1.242 . . . . 0.0 112.421 -179.968 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -0.944 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 p -135.41 45.27 2.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.808 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.7 t -73.14 -56.86 4.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.079 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.81 -35.91 64.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.287 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.93 -26.61 64.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.7 mtm-85 -107.94 23.94 13.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.282 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -90.18 160.39 40.18 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.8 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -87.69 28.71 11.3 Favored 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 123.631 -1.404 . . . . 0.0 112.925 0.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.59 57.3 27.64 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 0.0 110.823 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -82.22 -31.52 0.92 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.638 2.225 . . . . 0.0 112.464 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.13 175.83 5.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.125 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -96.87 -170.91 2.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.81 123.18 27.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.919 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 111.07 -20.08 24.31 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.359 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.7 mp -114.41 179.61 3.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.82 0.343 . . . . 0.0 110.783 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 76.4 m -150.85 147.84 27.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.002 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -88.07 126.05 34.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.1 t -86.97 141.34 28.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.036 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.427 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 1.3 pt -47.23 -28.47 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.11 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -65.11 -14.28 60.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.2 40.24 4.31 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.998 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -152.48 139.91 19.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.167 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.4 m -75.06 172.94 11.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.42 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . 164.28 -147.08 12.17 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.469 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 t -156.71 -170.85 3.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.909 0.385 . . . . 0.0 110.941 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.27 -160.38 46.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.5 -28.19 26.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 111.201 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.49 -35.26 79.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.234 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.42 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 89.8 m-85 -109.9 -29.95 8.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.015 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.8 t -124.06 53.24 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -90.78 -120.98 2.35 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.456 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.64 -43.67 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.923 0.392 . . . . 0.0 111.144 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.07 -12.05 18.95 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.718 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -103.81 27.07 7.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.711 0.291 . . . . 0.0 111.035 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 10.7 p -122.95 124.26 42.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.995 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -80.57 -56.46 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.867 179.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -136.8 162.42 33.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.931 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.22 46.19 6.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.614 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.5 t -104.28 -30.92 9.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.857 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.92 26.75 10.23 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.551 179.944 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.883 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.8 p -144.32 39.9 1.32 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 54.1 t -60.46 -31.63 70.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.936 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.21 -32.39 72.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.055 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 t -69.94 -22.3 63.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.167 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 75.6 mtm-85 -101.53 25.68 8.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.112 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -83.31 159.72 61.29 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.798 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -87.43 12.1 54.39 Favored 'Cis proline' 0 C--N 1.346 0.437 0 C-N-CA 123.472 -1.47 . . . . 0.0 112.802 0.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -126.45 65.61 59.97 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.751 0.31 . . . . 0.0 111.005 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -82.3 -43.0 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.685 2.256 . . . . 0.0 112.425 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.5 m -93.66 162.67 13.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.047 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.74 -169.84 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.762 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.89 128.92 34.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.036 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.97 -23.14 28.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.477 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.499 ' N ' HD12 ' A' ' 15' ' ' LEU . 1.9 mp -117.36 146.37 43.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.79 0.329 . . . . 0.0 110.902 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 m -111.88 171.84 7.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.34 124.07 40.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.428 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . 22.1 p -87.75 138.62 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.947 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.682 HG22 ' HB2' ' A' ' 36' ' ' ARG . 2.6 pt -46.99 -29.88 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.077 -179.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.401 ' N ' HG13 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -65.53 -14.11 60.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.214 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.9 41.07 3.91 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.101 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -155.97 146.24 21.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.839 0.352 . . . . 0.0 111.153 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.1 m -82.56 167.11 18.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.909 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.426 ' HA3' ' CD2' ' A' ' 29' ' ' TYR . . . 173.36 -152.37 15.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.577 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.8 p -149.21 -169.33 3.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.924 0.393 . . . . 0.0 111.045 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.66 -166.68 51.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.521 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.77 57.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.656 0.265 . . . . 0.0 111.455 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.16 -33.3 44.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.289 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.428 ' CD2' ' HB3' ' A' ' 18' ' ' SER . 48.1 m-85 -110.7 -30.51 7.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.1 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 67.0 m -118.86 37.67 4.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.821 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -88.65 -142.43 8.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.52 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.06 37.95 4.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 0.0 111.075 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -170.97 -41.21 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.419 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.515 ' O ' HG23 ' A' ' 19' ' ' ILE . 81.0 m-20 -80.28 -23.59 40.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.737 0.303 . . . . 0.0 111.08 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 22.6 p -79.98 106.25 11.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.032 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.682 ' HB2' HG22 ' A' ' 19' ' ' ILE . 27.5 ttp180 -80.25 -44.9 18.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.107 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.56 154.96 41.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.94 0.4 . . . . 0.0 111.293 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 63.72 46.92 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.112 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -128.45 -41.98 1.51 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -84.89 -25.94 27.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.871 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.382 -1.232 . . . . 0.0 112.519 179.991 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.892 0 N-CA-C 112.324 0.491 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.9 p -131.57 43.56 3.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.788 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -95.54 -34.51 12.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.925 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -62.86 -40.25 96.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.28 -26.34 66.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.413 ' HB3' ' HA ' ' A' ' 10' ' ' PRO . 2.7 mtt180 -79.87 -23.49 41.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.161 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.1 t -44.75 139.21 3.77 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -97.12 44.21 2.91 Favored 'Cis proline' 0 C--N 1.348 0.547 0 C-N-CA 124.388 -1.088 . . . . 0.0 113.21 0.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.457 ' N ' ' HD3' ' A' ' 10' ' ' PRO . 2.3 mmt180 -143.42 51.99 1.89 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.638 0.256 . . . . 0.0 111.423 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.457 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 88.0 Cg_endo -82.78 -32.7 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.536 2.157 . . . . 0.0 112.565 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -141.36 171.09 14.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.08 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.63 -171.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.889 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.17 138.86 32.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.18 -28.22 12.43 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.471 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.725 HD23 ' O ' ' A' ' 24' ' ' GLY . 0.8 OUTLIER -97.98 161.71 13.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.827 0.346 . . . . 0.0 110.807 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.4 m -133.13 163.69 28.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.0 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -100.96 128.51 46.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.711 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.5 p -90.05 143.08 27.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.227 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.488 HD12 ' N ' ' A' ' 20' ' ' TYR . 2.4 pp -45.87 -37.5 2.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.101 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.875 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.488 ' N ' HD12 ' A' ' 19' ' ' ILE . 30.3 m-85 -56.42 -21.95 28.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.967 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.91 44.25 1.95 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.176 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -154.39 141.94 19.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.834 0.349 . . . . 0.0 111.191 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.81 168.94 18.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.818 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.725 ' O ' HD23 ' A' ' 15' ' ' LEU . . . 170.51 -147.3 10.48 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.529 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 p -159.96 -176.65 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 59.4 -157.91 23.46 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.46 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -86.6 8.24 23.04 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.77 -36.41 15.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.806 0.336 . . . . 0.0 111.238 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.47 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 30.1 m-85 -127.87 1.14 6.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.673 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 t -125.33 -29.0 3.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.659 0.266 . . . . 0.0 111.296 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -56.3 176.75 0.87 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.773 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.16 154.06 42.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.341 . . . . 0.0 111.114 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 58.12 22.08 48.33 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.39 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -160.1 32.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.786 0.327 . . . . 0.0 110.709 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 44.5 t -141.26 118.21 11.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.098 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -87.56 -37.7 16.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.771 179.759 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.9 t -150.3 157.63 43.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.712 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 67.54 46.68 1.33 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.615 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 3.2 m -100.97 -32.51 10.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.813 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 -162.16 30.5 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.851 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.4 -1.222 . . . . 0.0 112.474 -179.969 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.9 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.1 p -140.44 48.4 1.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.729 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.407 ' HB2' ' CG ' ' A' ' 10' ' ' PRO . 20.4 p -85.28 -31.78 22.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.996 -179.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.65 -50.87 70.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -179.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.36 -23.69 63.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.296 -179.773 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 25.95 9.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.267 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.448 ' CB ' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -90.16 164.71 26.71 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.711 179.916 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HA ' ' CB ' ' A' ' 7' ' ' CYS . 90.5 Cg_endo -86.19 21.86 21.42 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.693 -1.378 . . . . 0.0 113.087 0.43 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.32 61.75 59.2 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.832 0.349 . . . . 0.0 110.829 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.407 ' CG ' ' HB2' ' A' ' 3' ' ' CYS . 85.5 Cg_endo -86.32 -47.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.752 2.301 . . . . 0.0 112.813 -179.723 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.8 m -110.45 -178.59 3.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.889 0.376 . . . . 0.0 111.029 -179.734 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -63.9 -177.31 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.866 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.0 134.37 36.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.105 -179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.83 -26.02 17.12 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -101.12 136.78 40.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.839 0.352 . . . . 0.0 110.956 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 30.3 m -104.57 161.81 13.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.851 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.9 t -97.79 106.34 18.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 p -67.1 139.9 57.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.83 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.4 pt -47.16 -33.77 2.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.797 -179.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -61.84 -17.87 57.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.075 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.1 42.7 2.55 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.09 -179.802 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -138.34 176.3 8.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.932 0.396 . . . . 0.0 111.152 -179.662 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -122.08 137.42 54.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.783 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.424 ' HA3' ' CG ' ' A' ' 29' ' ' TYR . . . -168.44 -158.87 12.97 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.548 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.6 p -142.31 -168.02 2.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.036 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.78 -169.88 19.76 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.511 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.409 ' HA ' ' CA ' ' A' ' 31' ' ' GLY . . . -76.2 -4.86 44.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.561 0.219 . . . . 0.0 111.582 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.93 -37.8 38.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.774 0.321 . . . . 0.0 111.24 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.424 ' CG ' ' HA3' ' A' ' 24' ' ' GLY . 66.7 m-85 -112.91 -28.06 7.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.385 -179.783 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.0 m -104.41 -23.1 13.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.267 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.409 ' CA ' ' HA ' ' A' ' 27' ' ' ALA . . . -57.51 155.33 19.04 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.617 -179.872 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.56 145.86 37.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.804 0.335 . . . . 0.0 111.137 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.41 26.75 69.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.504 -179.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -159.91 30.58 0.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.755 0.312 . . . . 0.0 110.921 -179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 29.0 p -148.26 125.71 11.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.991 -179.864 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.98 -58.42 3.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.854 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.415 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -131.67 168.45 17.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.877 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 62.94 46.81 4.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.808 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.34 -38.54 3.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.981 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -102.84 -31.67 10.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.431 -1.205 . . . . 0.0 112.529 -179.99 . . . . . . . . 0 0 . 1 stop_ save_